5-[1-(azetidin-3-yl)pyrazol-4-yl]-3-(pyrazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[4-[3-(3H-inden-1-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-[1-(2-methoxyethyl)pyrazol-4-yl]-3-(7H-pyrrolo[3,4-b]pyridin-5-ylmethyl)triazolo[4,5-b]pyrazine;3-[(3-methylindolizin-6-yl)methyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;2-[4-[3-[(3-methylindolizin-6-yl)methyl]triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[[5-[1-(oxetan-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole

C109H98N50O4S — CID 159786239

IUPAC5-[1-(azetidin-3-yl)pyrazol-4-yl]-3-(pyrazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[4-[3-(3H-inden-1-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-[1-(2-methoxyethyl)pyrazol-4-yl]-3-(7H-pyrrolo[3,4-b]pyridin-5-ylmethyl)triazolo[4,5-b]pyrazine;3-[(3-methylindolizin-6-yl)methyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;2-[4-[3-[(3-methylindolizin-6-yl)methyl]triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[[5-[1-(oxetan-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole
SMILESCOCCn1cc(-c2cnc3nnn(CC4=NCc5ncccc54)c3n2)cn1.Cc1ccc2ccc(Cn3nnc4ncc(-c5cnn(C)c5)nc43)cn12.Cc1ccc2ccc(Cn3nnc4ncc(-c5cnn(CCO)c5)nc43)cn12.OCCn1cc(-c2cnc3nnn(CC4=CCc5ccccc54)c3n2)cn1.c1cc2ccc(Cn3nnc4ncc(-c5cnn(C6CNC6)c5)nc43)cn2n1.c1cc2sc(Cn3nnc4ncc(-c5cnn(C6COC6)c5)nc43)cc2[nH]1
InChIInChI=1S/C19H18N8O.C19H17N7O.C18H16N10.C18H17N9O.C18H16N8.C17H14N8OS/c1-13-2-4-16-5-3-14(10-26(13)16)11-27-19-18(23-24-27)20-9-17(22-19)15-8-21-25(12-15)6-7-28;27-8-7-25-11-15(9-21-25)17-10-20-18-19(22-17)26(24-23-18)12-14-6-5-13-3-1-2-4-16(13)14;1-2-14-3-4-21-26(14)9-12(1)10-28-18-17(24-25-28)20-8-16(23-18)13-5-22-27(11-13)15-6-19-7-15;1-28-6-5-26-10-12(7-22-26)14-8-21-17-18(23-14)27(25-24-17)11-16-13-3-2-4-19-15(13)9-20-16;1-12-3-5-15-6-4-13(9-25(12)15)10-26-18-17(22-23-26)19-8-16(21-18)14-7-20-24(2)11-14;1-2-18-13-3-12(27-15(1)13)7-25-17-16(22-23-25)19-5-14(21-17)10-4-20-24(6-10)11-8-26-9-11/h2-5,8-10,12,28H,6-7,11H2,1H3;1-4,6,9-11,27H,5,7-8,12H2;1-5,8-9,11,15,19H,6-7,10H2;2-4,7-8,10H,5-6,9,11H2,1H3;3-9,11H,10H2,1-2H3;1-6,11,18H,7-9H2
InChIKeyNHZFDCBNANRKGK-UHFFFAOYSA-N
MW2204.40 g/mol
LogP9.94
Rot. Bonds27

About 5-[1-(azetidin-3-yl)pyrazol-4-yl]-3-(pyrazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[4-[3-(3H-inden-1-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-[1-(2-methoxyethyl)pyrazol-4-yl]-3-(7H-pyrrolo[3,4-b]pyridin-5-ylmethyl)triazolo[4,5-b]pyrazine;3-[(3-methylindolizin-6-yl)methyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;2-[4-[3-[(3-methylindolizin-6-yl)methyl]triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[[5-[1-(oxetan-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole

5-[1-(azetidin-3-yl)pyrazol-4-yl]-3-(pyrazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[4-[3-(3H-inden-1-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-[1-(2-methoxyethyl)pyrazol-4-yl]-3-(7H-pyrrolo[3,4-b]pyridin-5-ylmethyl)triazolo[4,5-b]pyrazine;3-[(3-methylindolizin-6-yl)methyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;2-[4-[3-[(3-methylindolizin-6-yl)methyl]triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[[5-[1-(oxetan-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole (PubChem CID 159786239) has the molecular formula C109H98N50O4S and a molecular weight of 2204.40 g/mol. Its IUPAC name is 5-[1-(azetidin-3-yl)pyrazol-4-yl]-3-(pyrazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[4-[3-(3H-inden-1-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-[1-(2-methoxyethyl)pyrazol-4-yl]-3-(7H-pyrrolo[3,4-b]pyridin-5-ylmethyl)triazolo[4,5-b]pyrazine;3-[(3-methylindolizin-6-yl)methyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;2-[4-[3-[(3-methylindolizin-6-yl)methyl]triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[[5-[1-(oxetan-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole.

Molecular Properties

Compound Name5-[1-(azetidin-3-yl)pyrazol-4-yl]-3-(pyrazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[4-[3-(3H-inden-1-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-[1-(2-methoxyethyl)pyrazol-4-yl]-3-(7H-pyrrolo[3,4-b]pyridin-5-ylmethyl)triazolo[4,5-b]pyrazine;3-[(3-methylindolizin-6-yl)methyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;2-[4-[3-[(3-methylindolizin-6-yl)methyl]triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[[5-[1-(oxetan-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole
PubChem CID159786239
Molecular FormulaC109H98N50O4S
Molecular Weight2204.40 g/mol
Exact Mass2202.87
IUPAC Name5-[1-(azetidin-3-yl)pyrazol-4-yl]-3-(pyrazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[4-[3-(3H-inden-1-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-[1-(2-methoxyethyl)pyrazol-4-yl]-3-(7H-pyrrolo[3,4-b]pyridin-5-ylmethyl)triazolo[4,5-b]pyrazine;3-[(3-methylindolizin-6-yl)methyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;2-[4-[3-[(3-methylindolizin-6-yl)methyl]triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[[5-[1-(oxetan-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole
SMILESCOCCn1cc(-c2cnc3nnn(CC4=NCc5ncccc54)c3n2)cn1.Cc1ccc2ccc(Cn3nnc4ncc(-c5cnn(C)c5)nc43)cn12.Cc1ccc2ccc(Cn3nnc4ncc(-c5cnn(CCO)c5)nc43)cn12.OCCn1cc(-c2cnc3nnn(CC4=CCc5ccccc54)c3n2)cn1.c1cc2ccc(Cn3nnc4ncc(-c5cnn(C6CNC6)c5)nc43)cn2n1.c1cc2sc(Cn3nnc4ncc(-c5cnn(C6COC6)c5)nc43)cc2[nH]1
InChIInChI=1S/C19H18N8O.C19H17N7O.C18H16N10.C18H17N9O.C18H16N8.C17H14N8OS/c1-13-2-4-16-5-3-14(10-26(13)16)11-27-19-18(23-24-27)20-9-17(22-19)15-8-21-25(12-15)6-7-28;27-8-7-25-11-15(9-21-25)17-10-20-18-19(22-17)26(24-23-18)12-14-6-5-13-3-1-2-4-16(13)14;1-2-14-3-4-21-26(14)9-12(1)10-28-18-17(24-25-28)20-8-16(23-18)13-5-22-27(11-13)15-6-19-7-15;1-28-6-5-26-10-12(7-22-26)14-8-21-17-18(23-14)27(25-24-17)11-16-13-3-2-4-19-15(13)9-20-16;1-12-3-5-15-6-4-13(9-25(12)15)10-26-18-17(22-23-26)19-8-16(21-18)14-7-20-24(2)11-14;1-2-18-13-3-12(27-15(1)13)7-25-17-16(22-23-25)19-5-14(21-17)10-4-20-24(6-10)11-8-26-9-11/h2-5,8-10,12,28H,6-7,11H2,1H3;1-4,6,9-11,27H,5,7-8,12H2;1-5,8-9,11,15,19H,6-7,10H2;2-4,7-8,10H,5-6,9,11H2,1H3;3-9,11H,10H2,1-2H3;1-6,11,18H,7-9H2
InChIKeyNHZFDCBNANRKGK-UHFFFAOYSA-N
XLogP9.94
TPSA583.97 Ų
H-Bond Donors4
H-Bond Acceptors54
Rotatable Bonds27
Heavy Atoms164
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002204.40
LogP ≤ 59.94
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1054

Analyze 5-[1-(azetidin-3-yl)pyrazol-4-yl]-3-(pyrazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[4-[3-(3H-inden-1-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-[1-(2-methoxyethyl)pyrazol-4-yl]-3-(7H-pyrrolo[3,4-b]pyridin-5-ylmethyl)triazolo[4,5-b]pyrazine;3-[(3-methylindolizin-6-yl)methyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;2-[4-[3-[(3-methylindolizin-6-yl)methyl]triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[[5-[1-(oxetan-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[[5-(6-isocyano-3-pyridinyl)triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole;6-[[5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazin-3-yl]methyl]-1,3-benzothiazole;6-[[5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazin-3-yl]methyl]thieno[2,3-b]pyridine;2-[4-[3-(pyrrolo[1,2-a]pyrimidin-2-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[4-[3-(pyrrolo[1,2-b]pyridazin-2-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[4-[3-(1H-pyrrolo[3,2-b]pyridin-2-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]-4H-pyrazol-1-ium-1-yl]ethanol;3-(7H-pyrrolo[3,4-b]pyridin-5-ylmethyl)-5-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine
CID 160132828
2-[[5-[1-(azetidin-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole;2-[4-[3-(1-benzothiophen-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-(1-cyclobutylpyrazol-4-yl)-3-(indolizin-6-ylmethyl)triazolo[4,5-b]pyrazine;3-(pyrrolo[1,2-a]pyrimidin-2-ylmethyl)-5-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine
CID 161121873
3-(1-benzothiophen-2-ylmethyl)-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;5-bromo-3-(pyrazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[(5-bromotriazolo[4,5-b]pyrazin-3-yl)methyl]-4H-thieno[3,2-b]pyrrole;2-[4-[3-(4H-cyclopenta[b]thiophen-2-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-(1-methylpyrazol-4-yl)-3-(pyrrolo[1,2-a]pyrazin-3-ylmethyl)triazolo[4,5-b]pyrazine;5-(1-methylpyrazol-4-yl)-3-(pyrrolo[1,2-a]pyrimidin-2-ylmethyl)triazolo[4,5-b]pyrazine;3-(pyrrolo[1,2-a]pyrimidin-2-ylmethyl)-5-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine
CID 162042928
4-[9-methyl-8-[(4-morpholin-4-ylpiperidin-1-yl)methyl]-2-(1H-pyrrolo[2,3-c]pyridin-4-yl)purin-6-yl]morpholine;4-[6-(morpholin-4-ylmethyl)-2-(1H-pyrrolo[3,2-c]pyridin-4-yl)thieno[3,2-d]pyrimidin-4-yl]morpholine
CID 87577839
(3R)-3-methyl-4-[4-(2-methylthiophen-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine;(3R)-3-methyl-4-[8-(1H-pyrazol-5-yl)-4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,7-naphthyridin-2-yl]morpholine
CID 135313206
4-[2-[7-[2-[2-[8-[2-[2-(4,7-dimethylpyrazolo[1,5-a]pyrazin-2-yl)ethyl]-[1,2,4]triazolo[5,1-f][1,6]naphthyridin-6-yl]-9H-imidazo[4,5-h]quinolin-2-yl]ethyl]-7-methylpyrazolo[1,5-a]pyrazin-4-yl]-4-methylpyrazolo[1,5-a]pyrazin-2-yl]ethyl]-5-methyl-7-thia-3,5,12-triazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),3,9,11-pentaene
CID 137284663
2,3-dihydro-1H-pyrrolizine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,5-a]pyridine;1H-imidazo[4,5-b]pyridine;bis(3H-imidazo[4,5-c]pyridine);imidazo[1,2-c]pyrimidine;indolizine;2H-isoindole;7H-purine;pyrazolo[1,5-a]pyridine;1H-pyrazolo[5,4-b]pyridine;pyrrolo[1,2-b]pyridazine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;4,5,6,7-tetrahydro-1,3-benzothiazole;4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine;4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine;4,5,6,7-tetrahydro-3H-pyrrolo[3,4-c]pyridine;[1,2,4]triazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine
CID 157084127
3-[(1R)-1-indolizin-6-ylethyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;4-[3-(indolizin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]morpholine;2-[4-[3-(indolizin-7-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;3-(1H-indol-3-ylmethyl)-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;5-(1-methylpyrazol-4-yl)-3-(1H-pyrrolo[3,2-b]pyridin-2-ylmethyl)triazolo[4,5-b]pyrazine;[6-[[5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazin-3-yl]methyl]indolizin-3-yl]methanol;2-[[5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazin-3-yl]methyl]thieno[2,3-b]pyridine
CID 157091024
5-tert-butyl-1-methylpyrrolo[2,3-b]pyridine;5-tert-butyl-1H-pyrrolo[2,3-b]pyridine;5-fluoro-1-methyl-4-propan-2-ylpyrrolo[2,3-b]pyridine;3-methyl-8-propan-2-ylimidazo[1,2-a]pyridine;3-methyl-8-propan-2-ylimidazo[1,5-a]pyridine;1-methyl-7-propan-2-ylimidazo[4,5-b]pyridine;3-methyl-7-propan-2-ylimidazo[4,5-b]pyridine;3-methyl-7-propan-2-ylpyrazolo[1,5-a]pyrimidine;1-methyl-4-propan-2-ylpyrazolo[3,4-b]pyridine;1-methyl-7-propan-2-ylpyrrolo[3,2-b]pyridine;7-methyl-4-propan-2-ylpyrrolo[2,3-d]pyrimidine;3-methyl-7-propan-2-ylthieno[3,2-b]pyridine;5-propan-2-ylimidazo[1,2-a]pyrazine;5-propan-2-ylimidazo[1,2-a]pyridine;7-propan-2-ylimidazo[1,2-a]pyridine;4-propan-2-ylpyrazolo[1,5-a]pyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;7-propan-2-ylpyrazolo[1,5-a]pyrimidine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;7-propan-2-ylthieno[3,2-b]pyridine
CID 157104385
2,3-dihydro-1H-pyrrolizine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,5-a]pyridine;3H-imidazo[4,5-c]pyridine;imidazo[1,2-c]pyrimidine;indolizine;2H-isoindole;7H-purine;pyrazolo[1,5-a]pyridine;1H-pyrazolo[5,4-c]pyridine;pyrrolo[1,2-b]pyridazine;4,5,6,7-tetrahydro-1,3-benzothiazole;4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine;4,5,6,7-tetrahydro-1H-pyrazolo[4,5-c]pyridine;4,5,6,7-tetrahydro-3H-pyrrolo[3,2-c]pyridine;4,5,6,7-tetrahydro-3H-pyrrolo[3,4-c]pyridine;[1,2,4]triazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine
CID 157430700
3-(4H-cyclopenta[b]thiophen-2-ylmethyl)-5-[1-(2-methoxyethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine;2-ethyl-5-[[5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazin-3-yl]methyl]thieno[3,2-c]pyrazole;4-[[6-[[5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazin-3-yl]methyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine
CID 157584876
2-[[5-[1-(azetidin-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole;2-[4-[3-(1-benzothiophen-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-(1-cyclobutylpyrazol-4-yl)-3-(indolizin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[[5-(6-isocyano-3-pyridinyl)triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole;6-[[5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazin-3-yl]methyl]-1,3-benzothiazole;6-[[5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazin-3-yl]methyl]thieno[2,3-b]pyridine;2-[4-[3-(pyrrolo[1,2-b]pyridazin-2-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol
CID 157794892

Frequently Asked Questions

What is the IUPAC name of 5-[1-(azetidin-3-yl)pyrazol-4-yl]-3-(pyrazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[4-[3-(3H-inden-1-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-[1-(2-methoxyethyl)pyrazol-4-yl]-3-(7H-pyrrolo[3,4-b]pyridin-5-ylmethyl)triazolo[4,5-b]pyrazine;3-[(3-methylindolizin-6-yl)methyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;2-[4-[3-[(3-methylindolizin-6-yl)methyl]triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[[5-[1-(oxetan-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole?
The IUPAC name of 5-[1-(azetidin-3-yl)pyrazol-4-yl]-3-(pyrazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[4-[3-(3H-inden-1-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-[1-(2-methoxyethyl)pyrazol-4-yl]-3-(7H-pyrrolo[3,4-b]pyridin-5-ylmethyl)triazolo[4,5-b]pyrazine;3-[(3-methylindolizin-6-yl)methyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;2-[4-[3-[(3-methylindolizin-6-yl)methyl]triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[[5-[1-(oxetan-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole (CID 159786239) is 5-[1-(azetidin-3-yl)pyrazol-4-yl]-3-(pyrazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[4-[3-(3H-inden-1-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-[1-(2-methoxyethyl)pyrazol-4-yl]-3-(7H-pyrrolo[3,4-b]pyridin-5-ylmethyl)triazolo[4,5-b]pyrazine;3-[(3-methylindolizin-6-yl)methyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;2-[4-[3-[(3-methylindolizin-6-yl)methyl]triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[[5-[1-(oxetan-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole.
What is the SMILES notation for 5-[1-(azetidin-3-yl)pyrazol-4-yl]-3-(pyrazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[4-[3-(3H-inden-1-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-[1-(2-methoxyethyl)pyrazol-4-yl]-3-(7H-pyrrolo[3,4-b]pyridin-5-ylmethyl)triazolo[4,5-b]pyrazine;3-[(3-methylindolizin-6-yl)methyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;2-[4-[3-[(3-methylindolizin-6-yl)methyl]triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[[5-[1-(oxetan-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole?
The canonical SMILES for 5-[1-(azetidin-3-yl)pyrazol-4-yl]-3-(pyrazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[4-[3-(3H-inden-1-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-[1-(2-methoxyethyl)pyrazol-4-yl]-3-(7H-pyrrolo[3,4-b]pyridin-5-ylmethyl)triazolo[4,5-b]pyrazine;3-[(3-methylindolizin-6-yl)methyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;2-[4-[3-[(3-methylindolizin-6-yl)methyl]triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[[5-[1-(oxetan-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole is COCCn1cc(-c2cnc3nnn(CC4=NCc5ncccc54)c3n2)cn1.Cc1ccc2ccc(Cn3nnc4ncc(-c5cnn(C)c5)nc43)cn12.Cc1ccc2ccc(Cn3nnc4ncc(-c5cnn(CCO)c5)nc43)cn12.OCCn1cc(-c2cnc3nnn(CC4=CCc5ccccc54)c3n2)cn1.c1cc2ccc(Cn3nnc4ncc(-c5cnn(C6CNC6)c5)nc43)cn2n1.c1cc2sc(Cn3nnc4ncc(-c5cnn(C6COC6)c5)nc43)cc2[nH]1.
What is the InChIKey of 5-[1-(azetidin-3-yl)pyrazol-4-yl]-3-(pyrazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[4-[3-(3H-inden-1-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-[1-(2-methoxyethyl)pyrazol-4-yl]-3-(7H-pyrrolo[3,4-b]pyridin-5-ylmethyl)triazolo[4,5-b]pyrazine;3-[(3-methylindolizin-6-yl)methyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;2-[4-[3-[(3-methylindolizin-6-yl)methyl]triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[[5-[1-(oxetan-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole?
The InChIKey is NHZFDCBNANRKGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N8O.C19H17N7O.C18H16N10.C18H17N9O.C18H16N8.C17H14N8OS/c1-13-2-4-16-5-3-14(10-26(13)16)11-27-19-18(23-24-27)20-9-17(22-19)15-8-21-25(12-15)6-7-28;27-8-7-25-11-15(9-21-25)17-10-20-18-19(22-17)26(24-23-18)12-14-6-5-13-3-1-2-4-16(13)14;1-2-14-3-4-21-26(14)9-12(1)10-28-18-17(24-25-28)20-8-16(23-18)13-5-22-27(11-13)15-6-19-7-15;1-28-6-5-26-10-12(7-22-26)14-8-21-17-18(23-14)27(25-24-17)11-16-13-3-2-4-19-15(13)9-20-16;1-12-3-5-15-6-4-13(9-25(12)15)10-26-18-17(22-23-26)19-8-16(21-18)14-7-20-24(2)11-14;1-2-18-13-3-12(27-15(1)13)7-25-17-16(22-23-25)19-5-14(21-17)10-4-20-24(6-10)11-8-26-9-11/h2-5,8-10,12,28H,6-7,11H2,1H3;1-4,6,9-11,27H,5,7-8,12H2;1-5,8-9,11,15,19H,6-7,10H2;2-4,7-8,10H,5-6,9,11H2,1H3;3-9,11H,10H2,1-2H3;1-6,11,18H,7-9H2.
What are the key properties of 5-[1-(azetidin-3-yl)pyrazol-4-yl]-3-(pyrazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[4-[3-(3H-inden-1-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-[1-(2-methoxyethyl)pyrazol-4-yl]-3-(7H-pyrrolo[3,4-b]pyridin-5-ylmethyl)triazolo[4,5-b]pyrazine;3-[(3-methylindolizin-6-yl)methyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;2-[4-[3-[(3-methylindolizin-6-yl)methyl]triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[[5-[1-(oxetan-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole?
5-[1-(azetidin-3-yl)pyrazol-4-yl]-3-(pyrazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[4-[3-(3H-inden-1-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-[1-(2-methoxyethyl)pyrazol-4-yl]-3-(7H-pyrrolo[3,4-b]pyridin-5-ylmethyl)triazolo[4,5-b]pyrazine;3-[(3-methylindolizin-6-yl)methyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;2-[4-[3-[(3-methylindolizin-6-yl)methyl]triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[[5-[1-(oxetan-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole has a molecular weight of 2204.40 g/mol, XLogP of 9.94, 27 rotatable bonds, 4 hydrogen bond donors, and 54 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(azetidin-3-yl)pyrazol-4-yl]-3-(pyrazolo[1,5-a]pyridin-6-ylmethyl)triazolo[4,5-b]pyrazine;2-[4-[3-(3H-inden-1-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;5-[1-(2-methoxyethyl)pyrazol-4-yl]-3-(7H-pyrrolo[3,4-b]pyridin-5-ylmethyl)triazolo[4,5-b]pyrazine;3-[(3-methylindolizin-6-yl)methyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine;2-[4-[3-[(3-methylindolizin-6-yl)methyl]triazolo[4,5-b]pyrazin-5-yl]pyrazol-1-yl]ethanol;2-[[5-[1-(oxetan-3-yl)pyrazol-4-yl]triazolo[4,5-b]pyrazin-3-yl]methyl]-4H-thieno[3,2-b]pyrrole is sourced from PubChem (CID 159786239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).