1-benzofuran;dibenzothiophene;3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole;bis(N-ethyl-N-methyl-1,3-thiazol-2-amine);2-(3-fluorophenyl)-1,3-thiazole;furo[2,3-c]pyridine;furo[3,2-c]pyridine;1-hydroxypyridin-1-ium;1H-imidazo[4,5-b]pyridine;isoquinoline;2-(2-methoxyethoxy)pyridine;2-(4-methoxyphenyl)-1H-pyrrole;2-methoxypyridine;3-methoxypyridine;1-methylindole;6-methyl-1H-indole;5-methyl-2H-isoindole;5-methyl-3-phenyl-1,2,4-oxadiazole;4-methyl-1-phenylpyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-phenylpyrimidine;2-piperidin-1-yl-1,3-thiazole;1-propylpyrazole;pyridin-2-amine;1H-pyrido[3,4-b][1,4]thiazine;1H-pyrrolo[2,3-b]pyridine;6H-pyrrolo[3,4-b]pyridine;quinazoline;1,2,3,4-tetrahydropyrrolo[1,2-a]pyrimidine;tetrazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine

C273H284FN56O11S11+ — CID 158977844

IUPAC1-benzofuran;dibenzothiophene;3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole;bis(N-ethyl-N-methyl-1,3-thiazol-2-amine);2-(3-fluorophenyl)-1,3-thiazole;furo[2,3-c]pyridine;furo[3,2-c]pyridine;1-hydroxypyridin-1-ium;1H-imidazo[4,5-b]pyridine;isoquinoline;2-(2-methoxyethoxy)pyridine;2-(4-methoxyphenyl)-1H-pyrrole;2-methoxypyridine;3-methoxypyridine;1-methylindole;6-methyl-1H-indole;5-methyl-2H-isoindole;5-methyl-3-phenyl-1,2,4-oxadiazole;4-methyl-1-phenylpyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-phenylpyrimidine;2-piperidin-1-yl-1,3-thiazole;1-propylpyrazole;pyridin-2-amine;1H-pyrido[3,4-b][1,4]thiazine;1H-pyrrolo[2,3-b]pyridine;6H-pyrrolo[3,4-b]pyridine;quinazoline;1,2,3,4-tetrahydropyrrolo[1,2-a]pyrimidine;tetrazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine
SMILESC1=CSc2cnccc2N1.CCCn1cccn1.CCN(C)c1nccs1.CCN(C)c1nccs1.COCCOc1ccccn1.COc1ccc(-c2ccc[nH]2)cc1.COc1ccccn1.COc1cccnc1.Cc1cc(C)on1.Cc1ccc2c[nH]cc2c1.Cc1ccc2cc[nH]c2c1.Cc1ccccn1.Cc1cccnc1.Cc1cccs1.Cc1ccncc1.Cc1cncs1.Cc1cnn(-c2ccccc2)c1.Cc1csc(C)n1.Cc1cscn1.Cc1nc(-c2ccccc2)no1.Cc1nccs1.Cn1ccc2ccccc21.Fc1cccc(-c2nccs2)c1.Nc1ccccn1.O[n+]1ccccc1.c1cc2ccoc2cn1.c1cc2n(c1)CCCN2.c1cc2occc2cn1.c1ccc(-c2ncccn2)cc1.c1ccc2c(c1)sc1ccccc12.c1ccc2cnccc2c1.c1ccc2ncncc2c1.c1ccc2occc2c1.c1ccn2cnnc2c1.c1ccn2nnnc2c1.c1cnc2[nH]ccc2c1.c1cnc2c[nH]cc2c1.c1cnc2nc[nH]c2c1.c1csc(N2CCCCC2)n1
InChIInChI=1S/C12H8S.C11H11NO.C10H10N2.C10H8N2.C9H6FNS.C9H8N2O.3C9H9N.C9H7N.C8H12N2S.C8H6N2.C8H11NO2.C8H6O.C7H6N2S.C7H10N2.2C7H6N2.2C7H5NO.2C6H5N3.2C6H10N2S.C6H10N2.2C6H7NO.3C6H7N.C5H4N4.C5H6N2.C5H7NO.C5H6NO.C5H7NS.C5H6S.3C4H5NS/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-13-10-6-4-9(5-7-10)11-3-2-8-12-11;1-9-7-11-12(8-9)10-5-3-2-4-6-10;1-2-5-9(6-3-1)10-11-7-4-8-12-10;10-8-3-1-2-7(6-8)9-11-4-5-12-9;1-7-10-9(11-12-7)8-5-3-2-4-6-8;1-7-2-3-8-5-10-6-9(8)4-7;1-7-2-3-8-4-5-10-9(8)6-7;1-10-7-6-8-4-2-3-5-9(8)10;1-2-4-9-7-10-6-5-8(9)3-1;1-2-5-10(6-3-1)8-9-4-7-11-8;1-2-4-8-7(3-1)5-9-6-10-8;1-10-6-7-11-8-4-2-3-5-9-8;1-2-4-8-7(3-1)5-6-9-8;1-2-8-5-7-6(1)9-3-4-10-7;1-3-7-8-4-2-6-9(7)5-1;1-2-6-3-5-9-7(6)8-4-1;1-2-6-4-8-5-7(6)9-3-1;1-3-8-5-6-2-4-9-7(1)6;1-3-8-5-7-6(1)2-4-9-7;1-2-5-6(7-3-1)9-4-8-5;1-2-4-9-5-7-8-6(9)3-1;2*1-3-8(2)6-7-4-5-9-6;1-2-5-8-6-3-4-7-8;1-8-6-3-2-4-7-5-6;1-8-6-4-2-3-5-7-6;1-6-2-4-7-5-3-6;1-6-3-2-4-7-5-6;1-6-4-2-3-5-7-6;1-2-4-9-5(3-1)6-7-8-9;6-5-3-1-2-4-7-5;1-4-3-5(2)7-6-4;7-6-4-2-1-3-5-6;1-4-3-7-5(2)6-4;1-5-3-2-4-6-5;1-4-2-6-3-5-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4/h1-8H;2-8,12H,1H3;2-8H,1H3;1-8H;1-6H;2-6H,1H3;2*2-6,10H,1H3;2-7H,1H3;1-7H;4,7H,1-3,5-6H2;1-6H;2-5H,6-7H2,1H3;1-6H;1-5,9H;1,3,5,8H,2,4,6H2;1-5H,(H,8,9);1-5,8H;2*1-5H;1-4H,(H,7,8,9);1-5H;2*4-5H,3H2,1-2H3;3-4,6H,2,5H2,1H3;2*2-5H,1H3;3*2-5H,1H3;1-4H;1-4H,(H2,6,7);3H,1-2H3;1-5,7H;3H,1-2H3;2-4H,1H3;3*2-3H,1H3/q;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;+1;;;;;
InChIKeyJOPQOJUUPBKMRE-UHFFFAOYSA-N
MW4897.39 g/mol
LogP65.88
Rot. Bonds19

About 1-benzofuran;dibenzothiophene;3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole;bis(N-ethyl-N-methyl-1,3-thiazol-2-amine);2-(3-fluorophenyl)-1,3-thiazole;furo[2,3-c]pyridine;furo[3,2-c]pyridine;1-hydroxypyridin-1-ium;1H-imidazo[4,5-b]pyridine;isoquinoline;2-(2-methoxyethoxy)pyridine;2-(4-methoxyphenyl)-1H-pyrrole;2-methoxypyridine;3-methoxypyridine;1-methylindole;6-methyl-1H-indole;5-methyl-2H-isoindole;5-methyl-3-phenyl-1,2,4-oxadiazole;4-methyl-1-phenylpyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-phenylpyrimidine;2-piperidin-1-yl-1,3-thiazole;1-propylpyrazole;pyridin-2-amine;1H-pyrido[3,4-b][1,4]thiazine;1H-pyrrolo[2,3-b]pyridine;6H-pyrrolo[3,4-b]pyridine;quinazoline;1,2,3,4-tetrahydropyrrolo[1,2-a]pyrimidine;tetrazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine

1-benzofuran;dibenzothiophene;3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole;bis(N-ethyl-N-methyl-1,3-thiazol-2-amine);2-(3-fluorophenyl)-1,3-thiazole;furo[2,3-c]pyridine;furo[3,2-c]pyridine;1-hydroxypyridin-1-ium;1H-imidazo[4,5-b]pyridine;isoquinoline;2-(2-methoxyethoxy)pyridine;2-(4-methoxyphenyl)-1H-pyrrole;2-methoxypyridine;3-methoxypyridine;1-methylindole;6-methyl-1H-indole;5-methyl-2H-isoindole;5-methyl-3-phenyl-1,2,4-oxadiazole;4-methyl-1-phenylpyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-phenylpyrimidine;2-piperidin-1-yl-1,3-thiazole;1-propylpyrazole;pyridin-2-amine;1H-pyrido[3,4-b][1,4]thiazine;1H-pyrrolo[2,3-b]pyridine;6H-pyrrolo[3,4-b]pyridine;quinazoline;1,2,3,4-tetrahydropyrrolo[1,2-a]pyrimidine;tetrazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 158977844) has the molecular formula C273H284FN56O11S11+ and a molecular weight of 4897.39 g/mol. Its IUPAC name is 1-benzofuran;dibenzothiophene;3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole;bis(N-ethyl-N-methyl-1,3-thiazol-2-amine);2-(3-fluorophenyl)-1,3-thiazole;furo[2,3-c]pyridine;furo[3,2-c]pyridine;1-hydroxypyridin-1-ium;1H-imidazo[4,5-b]pyridine;isoquinoline;2-(2-methoxyethoxy)pyridine;2-(4-methoxyphenyl)-1H-pyrrole;2-methoxypyridine;3-methoxypyridine;1-methylindole;6-methyl-1H-indole;5-methyl-2H-isoindole;5-methyl-3-phenyl-1,2,4-oxadiazole;4-methyl-1-phenylpyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-phenylpyrimidine;2-piperidin-1-yl-1,3-thiazole;1-propylpyrazole;pyridin-2-amine;1H-pyrido[3,4-b][1,4]thiazine;1H-pyrrolo[2,3-b]pyridine;6H-pyrrolo[3,4-b]pyridine;quinazoline;1,2,3,4-tetrahydropyrrolo[1,2-a]pyrimidine;tetrazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name1-benzofuran;dibenzothiophene;3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole;bis(N-ethyl-N-methyl-1,3-thiazol-2-amine);2-(3-fluorophenyl)-1,3-thiazole;furo[2,3-c]pyridine;furo[3,2-c]pyridine;1-hydroxypyridin-1-ium;1H-imidazo[4,5-b]pyridine;isoquinoline;2-(2-methoxyethoxy)pyridine;2-(4-methoxyphenyl)-1H-pyrrole;2-methoxypyridine;3-methoxypyridine;1-methylindole;6-methyl-1H-indole;5-methyl-2H-isoindole;5-methyl-3-phenyl-1,2,4-oxadiazole;4-methyl-1-phenylpyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-phenylpyrimidine;2-piperidin-1-yl-1,3-thiazole;1-propylpyrazole;pyridin-2-amine;1H-pyrido[3,4-b][1,4]thiazine;1H-pyrrolo[2,3-b]pyridine;6H-pyrrolo[3,4-b]pyridine;quinazoline;1,2,3,4-tetrahydropyrrolo[1,2-a]pyrimidine;tetrazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine
PubChem CID158977844
Molecular FormulaC273H284FN56O11S11+
Molecular Weight4897.39 g/mol
Exact Mass4893.03
IUPAC Name1-benzofuran;dibenzothiophene;3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole;bis(N-ethyl-N-methyl-1,3-thiazol-2-amine);2-(3-fluorophenyl)-1,3-thiazole;furo[2,3-c]pyridine;furo[3,2-c]pyridine;1-hydroxypyridin-1-ium;1H-imidazo[4,5-b]pyridine;isoquinoline;2-(2-methoxyethoxy)pyridine;2-(4-methoxyphenyl)-1H-pyrrole;2-methoxypyridine;3-methoxypyridine;1-methylindole;6-methyl-1H-indole;5-methyl-2H-isoindole;5-methyl-3-phenyl-1,2,4-oxadiazole;4-methyl-1-phenylpyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-phenylpyrimidine;2-piperidin-1-yl-1,3-thiazole;1-propylpyrazole;pyridin-2-amine;1H-pyrido[3,4-b][1,4]thiazine;1H-pyrrolo[2,3-b]pyridine;6H-pyrrolo[3,4-b]pyridine;quinazoline;1,2,3,4-tetrahydropyrrolo[1,2-a]pyrimidine;tetrazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine
SMILESC1=CSc2cnccc2N1.CCCn1cccn1.CCN(C)c1nccs1.CCN(C)c1nccs1.COCCOc1ccccn1.COc1ccc(-c2ccc[nH]2)cc1.COc1ccccn1.COc1cccnc1.Cc1cc(C)on1.Cc1ccc2c[nH]cc2c1.Cc1ccc2cc[nH]c2c1.Cc1ccccn1.Cc1cccnc1.Cc1cccs1.Cc1ccncc1.Cc1cncs1.Cc1cnn(-c2ccccc2)c1.Cc1csc(C)n1.Cc1cscn1.Cc1nc(-c2ccccc2)no1.Cc1nccs1.Cn1ccc2ccccc21.Fc1cccc(-c2nccs2)c1.Nc1ccccn1.O[n+]1ccccc1.c1cc2ccoc2cn1.c1cc2n(c1)CCCN2.c1cc2occc2cn1.c1ccc(-c2ncccn2)cc1.c1ccc2c(c1)sc1ccccc12.c1ccc2cnccc2c1.c1ccc2ncncc2c1.c1ccc2occc2c1.c1ccn2cnnc2c1.c1ccn2nnnc2c1.c1cnc2[nH]ccc2c1.c1cnc2c[nH]cc2c1.c1cnc2nc[nH]c2c1.c1csc(N2CCCCC2)n1
InChIInChI=1S/C12H8S.C11H11NO.C10H10N2.C10H8N2.C9H6FNS.C9H8N2O.3C9H9N.C9H7N.C8H12N2S.C8H6N2.C8H11NO2.C8H6O.C7H6N2S.C7H10N2.2C7H6N2.2C7H5NO.2C6H5N3.2C6H10N2S.C6H10N2.2C6H7NO.3C6H7N.C5H4N4.C5H6N2.C5H7NO.C5H6NO.C5H7NS.C5H6S.3C4H5NS/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-13-10-6-4-9(5-7-10)11-3-2-8-12-11;1-9-7-11-12(8-9)10-5-3-2-4-6-10;1-2-5-9(6-3-1)10-11-7-4-8-12-10;10-8-3-1-2-7(6-8)9-11-4-5-12-9;1-7-10-9(11-12-7)8-5-3-2-4-6-8;1-7-2-3-8-5-10-6-9(8)4-7;1-7-2-3-8-4-5-10-9(8)6-7;1-10-7-6-8-4-2-3-5-9(8)10;1-2-4-9-7-10-6-5-8(9)3-1;1-2-5-10(6-3-1)8-9-4-7-11-8;1-2-4-8-7(3-1)5-9-6-10-8;1-10-6-7-11-8-4-2-3-5-9-8;1-2-4-8-7(3-1)5-6-9-8;1-2-8-5-7-6(1)9-3-4-10-7;1-3-7-8-4-2-6-9(7)5-1;1-2-6-3-5-9-7(6)8-4-1;1-2-6-4-8-5-7(6)9-3-1;1-3-8-5-6-2-4-9-7(1)6;1-3-8-5-7-6(1)2-4-9-7;1-2-5-6(7-3-1)9-4-8-5;1-2-4-9-5-7-8-6(9)3-1;2*1-3-8(2)6-7-4-5-9-6;1-2-5-8-6-3-4-7-8;1-8-6-3-2-4-7-5-6;1-8-6-4-2-3-5-7-6;1-6-2-4-7-5-3-6;1-6-3-2-4-7-5-6;1-6-4-2-3-5-7-6;1-2-4-9-5(3-1)6-7-8-9;6-5-3-1-2-4-7-5;1-4-3-5(2)7-6-4;7-6-4-2-1-3-5-6;1-4-3-7-5(2)6-4;1-5-3-2-4-6-5;1-4-2-6-3-5-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4/h1-8H;2-8,12H,1H3;2-8H,1H3;1-8H;1-6H;2-6H,1H3;2*2-6,10H,1H3;2-7H,1H3;1-7H;4,7H,1-3,5-6H2;1-6H;2-5H,6-7H2,1H3;1-6H;1-5,9H;1,3,5,8H,2,4,6H2;1-5H,(H,8,9);1-5,8H;2*1-5H;1-4H,(H,7,8,9);1-5H;2*4-5H,3H2,1-2H3;3-4,6H,2,5H2,1H3;2*2-5H,1H3;3*2-5H,1H3;1-4H;1-4H,(H2,6,7);3H,1-2H3;1-5,7H;3H,1-2H3;2-4H,1H3;3*2-3H,1H3/q;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;+1;;;;;
InChIKeyJOPQOJUUPBKMRE-UHFFFAOYSA-N
XLogP65.88
TPSA795.97 Ų
H-Bond Donors10
H-Bond Acceptors71
Rotatable Bonds19
Heavy Atoms352
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004897.39
LogP ≤ 565.88
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1071

Analyze 1-benzofuran;dibenzothiophene;3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole;bis(N-ethyl-N-methyl-1,3-thiazol-2-amine);2-(3-fluorophenyl)-1,3-thiazole;furo[2,3-c]pyridine;furo[3,2-c]pyridine;1-hydroxypyridin-1-ium;1H-imidazo[4,5-b]pyridine;isoquinoline;2-(2-methoxyethoxy)pyridine;2-(4-methoxyphenyl)-1H-pyrrole;2-methoxypyridine;3-methoxypyridine;1-methylindole;6-methyl-1H-indole;5-methyl-2H-isoindole;5-methyl-3-phenyl-1,2,4-oxadiazole;4-methyl-1-phenylpyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-phenylpyrimidine;2-piperidin-1-yl-1,3-thiazole;1-propylpyrazole;pyridin-2-amine;1H-pyrido[3,4-b][1,4]thiazine;1H-pyrrolo[2,3-b]pyridine;6H-pyrrolo[3,4-b]pyridine;quinazoline;1,2,3,4-tetrahydropyrrolo[1,2-a]pyrimidine;tetrazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine with MolForge

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Launch Full Analysis

Related Compounds

2,4-dimethylfuro[3,2-c]pyridine;1,2-dimethylimidazole;1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;1,4-dimethylindole;2,4-dimethyl-1,3-oxazole;2,4-dimethyl-1H-pyrrolo[3,2-c]pyridine;1-methylbenzotriazole;4-methylfuro[3,2-c]pyridine;7-methylfuro[2,3-c]pyridine;2-methyl-1H-imidazole;4-methyl-1H-indazole;1-methylisoquinoline;2-methyl-3-prop-1-enylpyridine;4-methylthieno[2,3-d]pyrimidine;4-methyl-6-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidine
CID 157451853
1-benzofuran;5-(1,1-difluoroethyl)-1H-pyrazole;2-(1,1-difluoroethyl)pyridine;N,N-dimethylpyrazin-2-amine;2,3-dimethylpyridine;3,5-dimethylpyridine;N,N-dimethylpyrimidin-2-amine;2,4-dimethyl-1,3-thiazole;2-ethyl-6-methoxypyridine;N-ethyl-N-methyl-1,3-thiazol-2-amine;2-fluoro-3-methylpyridine;2-fluoropyridine;4-fluoropyridine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;2-(2-methoxyethoxy)pyridine;2-methoxypyridine;3-methoxypyridine;4-methoxypyridine;2-methylpyrazine;2-methylpyridine;tris(3-methylpyridine);4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;1-propylpyrazole;1H-pyrido[3,4-b][1,4]thiazine;2-pyrrolidin-1-yl-1,3-thiazole;3-(trifluoromethyl)pyridine;4-(trifluoromethyl)pyridine
CID 157457452
benzene;1,3-benzodioxole;1,3-benzothiazole;1-benzothiophene;1,2,4-benzotriazine;cinnoline;cyclopenta-1,3-diene;dibenzofuran;dibenzothiophene;2,2-difluoro-1,3-benzodioxole;2,3-dihydro-1,4-benzodioxine;ethane;9H-fluorene;furan;bis(1H-indole);1-methylimidazole;1-methylindole;morpholine;oxane;1,3-oxazole;[1,3]oxazolo[4,5-c]pyridine;phenol;phenylmethanol;piperidine;pyridine;pyrimidine;quinazoline;quinoline;thiane;1,3-thiazole;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thiophene;triazine;1,3,5-triazine
CID 157518381
N-(1,5-dimethylbenzimidazol-2-yl)acetamide;N-(1,5-dimethylbenzimidazol-2-yl)methanesulfonamide;1,3-dimethyl-5-(trifluoromethyl)benzene;5-fluoro-2-methyl-1-benzofuran;5-fluoro-2-methyl-1-benzothiophene;5-fluoro-2-methyl-1H-indole;N-(6-methyl-1H-benzimidazol-2-yl)acetamide;N-(6-methyl-1H-benzimidazol-2-yl)methanesulfonamide;6-methyl-1,2-benzothiazole;N-(5-methyl-1,3-benzothiazol-2-yl)acetamide;N-(5-methyl-1,3-benzothiazol-2-yl)methanesulfonamide;6-methyl-1,2-benzoxazole;N-(5-methyl-1,3-benzoxazol-2-yl)acetamide;N-(5-methyl-1,3-benzoxazol-2-yl)methanesulfonamide;2-methylfuro[2,3-b]pyridine;3-methyl-2H-indazole;6-methyl-1H-indazole;3-methyl-1,5-naphthyridine;2-methyl-1H-pyrrolo[2,3-b]pyridine;6-methylquinoline;7-methylquinoline;6-methylquinoxaline;2-methylthieno[2,3-b]pyridine
CID 157645993
1H-benzimidazole;1-(2-chlorophenyl)pyrazole;5-(1,1-difluoroethyl)-1-methylpyrazole;2,3-dihydro-1H-benzo[de]isoquinoline;2,3-dihydro-1H-indole;1-(3,4-dimethylphenyl)pyrazole;3,5-dimethylpyridine;1-(2-fluorophenyl)pyrazole;2-methoxypyridine;3-methoxypyridine;6-methylimidazo[1,2-a]pyridine;5-methyl-3-phenyl-1,2,4-oxadiazole;1-(3-methylphenyl)pyrazole;1-(4-methylphenyl)pyrazole;1,6-naphthyridine;2-pyridin-3-yl-1,3-oxazole;3-(1H-pyrrol-2-yl)pyridine;4-(3H-pyrrol-5-yl)pyridine;quinoline;5,6,7,8-tetrahydro-1,6-naphthyridine;thieno[2,3-b]pyrazine;2-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 157674447
1,3-benzothiazole;1-benzothiophene;6-chloroimidazo[1,2-a]pyridine;1,2-dimethylimidazole;1,4-dimethylimidazole;1,5-dimethylimidazole;1-(3,4-dimethylphenyl)pyrazole;3,5-dimethylpyridine;furan;furo[2,3-c]pyridine;imidazo[1,2-a]pyridine;1H-imidazole;1H-indazole;2-methoxypyridine;3-methoxypyridine;2-methyl-1H-imidazole;bis(1-methylindazole);2-methylpyrimidine;1-methylpyrrolo[2,3-c]pyridine;1-methyl-5-(trifluoromethyl)pyrazole;1,2-oxazole;1,3-oxazole;1-propylpyrazole;pyrazine;1H-pyrazole;1H-pyrazolo[5,4-b]pyridine;pyridazine;pyridine;pyrido[4,3-b][1,6]naphthyridine;bis(pyrimidine);1H-pyrrole;5H-pyrrolo[1,2-a]imidazole;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;1,2-thiazole;1,3-thiazole;thieno[2,3-b]pyridine;thieno[3,2-b]thiophene;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thiophene;1,3,5-triazine;2-(trifluoromethyl)imidazo[1,2-a]pyridine;5-(trifluoromethyl)-1H-pyrazole
CID 157712548
benzo[b][1,6]naphthyridine;1,3-benzothiazole;1-benzothiophene;6-chloroimidazo[1,2-a]pyridine;5-(1,1-difluoroethyl)-1-methylpyrazole;5-(1,1-difluoroethyl)-1H-pyrazole;1,2-dimethylimidazole;1,4-dimethylimidazole;1,5-dimethylimidazole;1-(3,4-dimethylphenyl)pyrazole;3,5-dimethylpyridine;furan;furo[2,3-c]pyridine;imidazo[1,2-a]pyridine;1H-imidazole;1H-indazole;methane;2-methoxypyridine;3-methoxypyridine;2-methyl-1H-imidazole;bis(1-methylindazole);2-methylpyrimidine;1-methylpyrrolo[2,3-c]pyridine;1,2-oxazole;1,3-oxazole;1-propylpyrazole;pyrazine;1H-pyrazole;1H-pyrazolo[5,4-b]pyridine;pyridazine;pyridine;bis(pyrimidine);1H-pyrrole;5H-pyrrolo[1,2-a]imidazole;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;1,2-thiazole;1,3-thiazole;thieno[2,3-b]pyridine;thieno[3,2-b]thiophene;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thiophene;1,3,5-triazine;2-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 157989050
1,3-benzothiazole;1-benzothiophene;6-chloroimidazo[1,2-a]pyridine;1,2-dimethylimidazole;1,4-dimethylimidazole;1,5-dimethylimidazole;furan;furo[2,3-c]pyridine;imidazo[1,2-a]pyridine;5H-imidazo[1,2-b]pyrazole;1H-imidazole;1H-indazole;2-methyl-1H-imidazole;bis(1-methylindazole);2-methylpyrimidine;1-methylpyrrolo[2,3-c]pyridine;1-methyl-5-(trifluoromethyl)pyrazole;1,2-oxazole;1,3-oxazole;1-propylpyrazole;pyrazine;1H-pyrazole;1H-pyrazolo[5,4-b]pyridine;pyridazine;pyridine;pyrido[4,3-b][1,6]naphthyridine;pyrimidine;1H-pyrrole;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;1,2-thiazole;1,3-thiazole;thieno[2,3-b]pyridine;thieno[3,2-b]thiophene;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thiophene;1,2,4-triazine;1,3,5-triazine;5-(trifluoromethyl)-1H-pyrazole
CID 158082249
benzo[b][1,6]naphthyridine;1,3-benzothiazole;1-benzothiophene;1,2-dimethylimidazole;1,4-dimethylimidazole;1,5-dimethylimidazole;furan;furo[2,3-c]pyridine;imidazo[1,2-a]pyridine;1H-imidazole;1H-indazole;2-methyl-1H-imidazole;bis(1-methylindazole);2-methylpyrimidine;1-methylpyrrolo[2,3-c]pyridine;1,2-oxazole;1,3-oxazole;1-propylpyrazole;pyrazine;1H-pyrazole;pyridazine;pyridine;pyrimidine;1H-pyrrole;5H-pyrrolo[1,2-a]imidazole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;1,2-thiazole;1,3-thiazole;thieno[2,3-b]pyridine;thieno[3,2-b]thiophene;bis(thieno[2,3-c]pyridine);thiophene;1,3,5-triazine;5-(trifluoromethyl)-1H-pyrazole
CID 158113572
CID 158162477
CID 158162477
1-benzyl-4-methylpyrazole;2-chloro-4,6-dimethylpyrimidine;4-chloro-2,6-dimethylpyrimidine;4-chloro-6-methyl-2-methylsulfanylpyrimidine;1-chloro-3-methylnaphthalene;2-chloro-4-methylpyrimidine;4-chloro-2-methylpyrimidine;4-chloro-6-methylpyrimidine;2,4-dimethoxy-6-methylpyrimidine;1,2-dimethylbenzimidazole;3,4-dimethyl-1,2,5-oxadiazole;6,9-dimethylpurine;1,4-dimethylpyrazole;methane;2-methoxy-7-methylnaphthalene;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;7-methylfuro[2,3-c]pyridine;4-methyl-1H-indole;7-methyl-1H-indole;1-methylisoquinoline;6-methyl-2-methylsulfanylpyrimidin-4-amine;4-methyl-2-methylsulfanylpyrimidine;4-methyl-1-propylimidazo[4,5-c]pyridine;6-methyl-7H-purine;2-methylpyrimidine;4-methylquinazoline;2-methylquinoline;2-methyl-1,3-thiazole;4-methylthieno[2,3-d]pyrimidine;2-methyl-5-(trifluoromethyl)-1,3,4-thiadiazole;2,3,5-trimethylpyrazine
CID 158316999
CID 158395365
CID 158395365

Frequently Asked Questions

What is the IUPAC name of 1-benzofuran;dibenzothiophene;3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole;bis(N-ethyl-N-methyl-1,3-thiazol-2-amine);2-(3-fluorophenyl)-1,3-thiazole;furo[2,3-c]pyridine;furo[3,2-c]pyridine;1-hydroxypyridin-1-ium;1H-imidazo[4,5-b]pyridine;isoquinoline;2-(2-methoxyethoxy)pyridine;2-(4-methoxyphenyl)-1H-pyrrole;2-methoxypyridine;3-methoxypyridine;1-methylindole;6-methyl-1H-indole;5-methyl-2H-isoindole;5-methyl-3-phenyl-1,2,4-oxadiazole;4-methyl-1-phenylpyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-phenylpyrimidine;2-piperidin-1-yl-1,3-thiazole;1-propylpyrazole;pyridin-2-amine;1H-pyrido[3,4-b][1,4]thiazine;1H-pyrrolo[2,3-b]pyridine;6H-pyrrolo[3,4-b]pyridine;quinazoline;1,2,3,4-tetrahydropyrrolo[1,2-a]pyrimidine;tetrazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 1-benzofuran;dibenzothiophene;3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole;bis(N-ethyl-N-methyl-1,3-thiazol-2-amine);2-(3-fluorophenyl)-1,3-thiazole;furo[2,3-c]pyridine;furo[3,2-c]pyridine;1-hydroxypyridin-1-ium;1H-imidazo[4,5-b]pyridine;isoquinoline;2-(2-methoxyethoxy)pyridine;2-(4-methoxyphenyl)-1H-pyrrole;2-methoxypyridine;3-methoxypyridine;1-methylindole;6-methyl-1H-indole;5-methyl-2H-isoindole;5-methyl-3-phenyl-1,2,4-oxadiazole;4-methyl-1-phenylpyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-phenylpyrimidine;2-piperidin-1-yl-1,3-thiazole;1-propylpyrazole;pyridin-2-amine;1H-pyrido[3,4-b][1,4]thiazine;1H-pyrrolo[2,3-b]pyridine;6H-pyrrolo[3,4-b]pyridine;quinazoline;1,2,3,4-tetrahydropyrrolo[1,2-a]pyrimidine;tetrazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine (CID 158977844) is 1-benzofuran;dibenzothiophene;3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole;bis(N-ethyl-N-methyl-1,3-thiazol-2-amine);2-(3-fluorophenyl)-1,3-thiazole;furo[2,3-c]pyridine;furo[3,2-c]pyridine;1-hydroxypyridin-1-ium;1H-imidazo[4,5-b]pyridine;isoquinoline;2-(2-methoxyethoxy)pyridine;2-(4-methoxyphenyl)-1H-pyrrole;2-methoxypyridine;3-methoxypyridine;1-methylindole;6-methyl-1H-indole;5-methyl-2H-isoindole;5-methyl-3-phenyl-1,2,4-oxadiazole;4-methyl-1-phenylpyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-phenylpyrimidine;2-piperidin-1-yl-1,3-thiazole;1-propylpyrazole;pyridin-2-amine;1H-pyrido[3,4-b][1,4]thiazine;1H-pyrrolo[2,3-b]pyridine;6H-pyrrolo[3,4-b]pyridine;quinazoline;1,2,3,4-tetrahydropyrrolo[1,2-a]pyrimidine;tetrazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 1-benzofuran;dibenzothiophene;3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole;bis(N-ethyl-N-methyl-1,3-thiazol-2-amine);2-(3-fluorophenyl)-1,3-thiazole;furo[2,3-c]pyridine;furo[3,2-c]pyridine;1-hydroxypyridin-1-ium;1H-imidazo[4,5-b]pyridine;isoquinoline;2-(2-methoxyethoxy)pyridine;2-(4-methoxyphenyl)-1H-pyrrole;2-methoxypyridine;3-methoxypyridine;1-methylindole;6-methyl-1H-indole;5-methyl-2H-isoindole;5-methyl-3-phenyl-1,2,4-oxadiazole;4-methyl-1-phenylpyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-phenylpyrimidine;2-piperidin-1-yl-1,3-thiazole;1-propylpyrazole;pyridin-2-amine;1H-pyrido[3,4-b][1,4]thiazine;1H-pyrrolo[2,3-b]pyridine;6H-pyrrolo[3,4-b]pyridine;quinazoline;1,2,3,4-tetrahydropyrrolo[1,2-a]pyrimidine;tetrazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 1-benzofuran;dibenzothiophene;3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole;bis(N-ethyl-N-methyl-1,3-thiazol-2-amine);2-(3-fluorophenyl)-1,3-thiazole;furo[2,3-c]pyridine;furo[3,2-c]pyridine;1-hydroxypyridin-1-ium;1H-imidazo[4,5-b]pyridine;isoquinoline;2-(2-methoxyethoxy)pyridine;2-(4-methoxyphenyl)-1H-pyrrole;2-methoxypyridine;3-methoxypyridine;1-methylindole;6-methyl-1H-indole;5-methyl-2H-isoindole;5-methyl-3-phenyl-1,2,4-oxadiazole;4-methyl-1-phenylpyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-phenylpyrimidine;2-piperidin-1-yl-1,3-thiazole;1-propylpyrazole;pyridin-2-amine;1H-pyrido[3,4-b][1,4]thiazine;1H-pyrrolo[2,3-b]pyridine;6H-pyrrolo[3,4-b]pyridine;quinazoline;1,2,3,4-tetrahydropyrrolo[1,2-a]pyrimidine;tetrazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine is C1=CSc2cnccc2N1.CCCn1cccn1.CCN(C)c1nccs1.CCN(C)c1nccs1.COCCOc1ccccn1.COc1ccc(-c2ccc[nH]2)cc1.COc1ccccn1.COc1cccnc1.Cc1cc(C)on1.Cc1ccc2c[nH]cc2c1.Cc1ccc2cc[nH]c2c1.Cc1ccccn1.Cc1cccnc1.Cc1cccs1.Cc1ccncc1.Cc1cncs1.Cc1cnn(-c2ccccc2)c1.Cc1csc(C)n1.Cc1cscn1.Cc1nc(-c2ccccc2)no1.Cc1nccs1.Cn1ccc2ccccc21.Fc1cccc(-c2nccs2)c1.Nc1ccccn1.O[n+]1ccccc1.c1cc2ccoc2cn1.c1cc2n(c1)CCCN2.c1cc2occc2cn1.c1ccc(-c2ncccn2)cc1.c1ccc2c(c1)sc1ccccc12.c1ccc2cnccc2c1.c1ccc2ncncc2c1.c1ccc2occc2c1.c1ccn2cnnc2c1.c1ccn2nnnc2c1.c1cnc2[nH]ccc2c1.c1cnc2c[nH]cc2c1.c1cnc2nc[nH]c2c1.c1csc(N2CCCCC2)n1.
What is the InChIKey of 1-benzofuran;dibenzothiophene;3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole;bis(N-ethyl-N-methyl-1,3-thiazol-2-amine);2-(3-fluorophenyl)-1,3-thiazole;furo[2,3-c]pyridine;furo[3,2-c]pyridine;1-hydroxypyridin-1-ium;1H-imidazo[4,5-b]pyridine;isoquinoline;2-(2-methoxyethoxy)pyridine;2-(4-methoxyphenyl)-1H-pyrrole;2-methoxypyridine;3-methoxypyridine;1-methylindole;6-methyl-1H-indole;5-methyl-2H-isoindole;5-methyl-3-phenyl-1,2,4-oxadiazole;4-methyl-1-phenylpyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-phenylpyrimidine;2-piperidin-1-yl-1,3-thiazole;1-propylpyrazole;pyridin-2-amine;1H-pyrido[3,4-b][1,4]thiazine;1H-pyrrolo[2,3-b]pyridine;6H-pyrrolo[3,4-b]pyridine;quinazoline;1,2,3,4-tetrahydropyrrolo[1,2-a]pyrimidine;tetrazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is JOPQOJUUPBKMRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8S.C11H11NO.C10H10N2.C10H8N2.C9H6FNS.C9H8N2O.3C9H9N.C9H7N.C8H12N2S.C8H6N2.C8H11NO2.C8H6O.C7H6N2S.C7H10N2.2C7H6N2.2C7H5NO.2C6H5N3.2C6H10N2S.C6H10N2.2C6H7NO.3C6H7N.C5H4N4.C5H6N2.C5H7NO.C5H6NO.C5H7NS.C5H6S.3C4H5NS/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-13-10-6-4-9(5-7-10)11-3-2-8-12-11;1-9-7-11-12(8-9)10-5-3-2-4-6-10;1-2-5-9(6-3-1)10-11-7-4-8-12-10;10-8-3-1-2-7(6-8)9-11-4-5-12-9;1-7-10-9(11-12-7)8-5-3-2-4-6-8;1-7-2-3-8-5-10-6-9(8)4-7;1-7-2-3-8-4-5-10-9(8)6-7;1-10-7-6-8-4-2-3-5-9(8)10;1-2-4-9-7-10-6-5-8(9)3-1;1-2-5-10(6-3-1)8-9-4-7-11-8;1-2-4-8-7(3-1)5-9-6-10-8;1-10-6-7-11-8-4-2-3-5-9-8;1-2-4-8-7(3-1)5-6-9-8;1-2-8-5-7-6(1)9-3-4-10-7;1-3-7-8-4-2-6-9(7)5-1;1-2-6-3-5-9-7(6)8-4-1;1-2-6-4-8-5-7(6)9-3-1;1-3-8-5-6-2-4-9-7(1)6;1-3-8-5-7-6(1)2-4-9-7;1-2-5-6(7-3-1)9-4-8-5;1-2-4-9-5-7-8-6(9)3-1;2*1-3-8(2)6-7-4-5-9-6;1-2-5-8-6-3-4-7-8;1-8-6-3-2-4-7-5-6;1-8-6-4-2-3-5-7-6;1-6-2-4-7-5-3-6;1-6-3-2-4-7-5-6;1-6-4-2-3-5-7-6;1-2-4-9-5(3-1)6-7-8-9;6-5-3-1-2-4-7-5;1-4-3-5(2)7-6-4;7-6-4-2-1-3-5-6;1-4-3-7-5(2)6-4;1-5-3-2-4-6-5;1-4-2-6-3-5-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4/h1-8H;2-8,12H,1H3;2-8H,1H3;1-8H;1-6H;2-6H,1H3;2*2-6,10H,1H3;2-7H,1H3;1-7H;4,7H,1-3,5-6H2;1-6H;2-5H,6-7H2,1H3;1-6H;1-5,9H;1,3,5,8H,2,4,6H2;1-5H,(H,8,9);1-5,8H;2*1-5H;1-4H,(H,7,8,9);1-5H;2*4-5H,3H2,1-2H3;3-4,6H,2,5H2,1H3;2*2-5H,1H3;3*2-5H,1H3;1-4H;1-4H,(H2,6,7);3H,1-2H3;1-5,7H;3H,1-2H3;2-4H,1H3;3*2-3H,1H3/q;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;+1;;;;;.
What are the key properties of 1-benzofuran;dibenzothiophene;3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole;bis(N-ethyl-N-methyl-1,3-thiazol-2-amine);2-(3-fluorophenyl)-1,3-thiazole;furo[2,3-c]pyridine;furo[3,2-c]pyridine;1-hydroxypyridin-1-ium;1H-imidazo[4,5-b]pyridine;isoquinoline;2-(2-methoxyethoxy)pyridine;2-(4-methoxyphenyl)-1H-pyrrole;2-methoxypyridine;3-methoxypyridine;1-methylindole;6-methyl-1H-indole;5-methyl-2H-isoindole;5-methyl-3-phenyl-1,2,4-oxadiazole;4-methyl-1-phenylpyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-phenylpyrimidine;2-piperidin-1-yl-1,3-thiazole;1-propylpyrazole;pyridin-2-amine;1H-pyrido[3,4-b][1,4]thiazine;1H-pyrrolo[2,3-b]pyridine;6H-pyrrolo[3,4-b]pyridine;quinazoline;1,2,3,4-tetrahydropyrrolo[1,2-a]pyrimidine;tetrazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine?
1-benzofuran;dibenzothiophene;3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole;bis(N-ethyl-N-methyl-1,3-thiazol-2-amine);2-(3-fluorophenyl)-1,3-thiazole;furo[2,3-c]pyridine;furo[3,2-c]pyridine;1-hydroxypyridin-1-ium;1H-imidazo[4,5-b]pyridine;isoquinoline;2-(2-methoxyethoxy)pyridine;2-(4-methoxyphenyl)-1H-pyrrole;2-methoxypyridine;3-methoxypyridine;1-methylindole;6-methyl-1H-indole;5-methyl-2H-isoindole;5-methyl-3-phenyl-1,2,4-oxadiazole;4-methyl-1-phenylpyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-phenylpyrimidine;2-piperidin-1-yl-1,3-thiazole;1-propylpyrazole;pyridin-2-amine;1H-pyrido[3,4-b][1,4]thiazine;1H-pyrrolo[2,3-b]pyridine;6H-pyrrolo[3,4-b]pyridine;quinazoline;1,2,3,4-tetrahydropyrrolo[1,2-a]pyrimidine;tetrazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 4897.39 g/mol, XLogP of 65.88, 19 rotatable bonds, 10 hydrogen bond donors, and 71 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzofuran;dibenzothiophene;3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole;bis(N-ethyl-N-methyl-1,3-thiazol-2-amine);2-(3-fluorophenyl)-1,3-thiazole;furo[2,3-c]pyridine;furo[3,2-c]pyridine;1-hydroxypyridin-1-ium;1H-imidazo[4,5-b]pyridine;isoquinoline;2-(2-methoxyethoxy)pyridine;2-(4-methoxyphenyl)-1H-pyrrole;2-methoxypyridine;3-methoxypyridine;1-methylindole;6-methyl-1H-indole;5-methyl-2H-isoindole;5-methyl-3-phenyl-1,2,4-oxadiazole;4-methyl-1-phenylpyrazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-phenylpyrimidine;2-piperidin-1-yl-1,3-thiazole;1-propylpyrazole;pyridin-2-amine;1H-pyrido[3,4-b][1,4]thiazine;1H-pyrrolo[2,3-b]pyridine;6H-pyrrolo[3,4-b]pyridine;quinazoline;1,2,3,4-tetrahydropyrrolo[1,2-a]pyrimidine;tetrazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 158977844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).