5-chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-cyclopropyl-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;bis(N-[4,5-difluoro-2-[[4-hydroxy-4-(trifluoromethyl)cyclohexyl]carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide);5-(difluoromethoxy)-4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoic acid

C109H83ClF16N32O19 — CID 158435323

IUPAC5-chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-cyclopropyl-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;bis(N-[4,5-difluoro-2-[[4-hydroxy-4-(trifluoromethyl)cyclohexyl]carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide);5-(difluoromethoxy)-4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoic acid
SMILESO=C(Nc1cc(C(F)(F)F)ccc1C(=O)O)c1ccc(-n2ccnc2)nn1.O=C(Nc1cc(F)c(F)cc1C(=O)NC1CCC(O)(C(F)(F)F)CC1)c1ccc(-n2ccnc2)nn1.O=C(Nc1cc(F)c(F)cc1C(=O)NC1CCC(O)(C(F)(F)F)CC1)c1ccc(-n2ccnc2)nn1.O=C(Nc1cc(F)c(OC(F)F)cc1C(=O)O)c1ccc(-n2ccnc2)nn1.O=C(Nc1ccc(C2CC2)cc1C(=O)O)c1ccc(-n2ccnc2)nn1.O=C(Nc1ccc(Cl)cc1C(=O)O)c1ccc(-n2ccnc2)nn1
InChIInChI=1S/2C22H19F5N6O3.C18H15N5O3.C16H10F3N5O4.C16H10F3N5O3.C15H10ClN5O3/c2*23-14-9-13(19(34)29-12-3-5-21(36,6-4-12)22(25,26)27)17(10-15(14)24)30-20(35)16-1-2-18(32-31-16)33-8-7-28-11-33;24-17(15-5-6-16(22-21-15)23-8-7-19-10-23)20-14-4-3-12(11-1-2-11)9-13(14)18(25)26;17-9-6-11(8(15(26)27)5-12(9)28-16(18)19)21-14(25)10-1-2-13(23-22-10)24-4-3-20-7-24;17-16(18,19)9-1-2-10(15(26)27)12(7-9)21-14(25)11-3-4-13(23-22-11)24-6-5-20-8-24;16-9-1-2-11(10(7-9)15(23)24)18-14(22)12-3-4-13(20-19-12)21-6-5-17-8-21/h2*1-2,7-12,36H,3-6H2,(H,29,34)(H,30,35);3-11H,1-2H2,(H,20,24)(H,25,26);1-7,16H,(H,21,25)(H,26,27);1-8H,(H,21,25)(H,26,27);1-8H,(H,18,22)(H,23,24)
InChIKeyHCDQNARGGSQLSH-UHFFFAOYSA-N
MW2484.49 g/mol
LogP16.06
Rot. Bonds29

About 5-chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-cyclopropyl-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;bis(N-[4,5-difluoro-2-[[4-hydroxy-4-(trifluoromethyl)cyclohexyl]carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide);5-(difluoromethoxy)-4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoic acid

5-chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-cyclopropyl-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;bis(N-[4,5-difluoro-2-[[4-hydroxy-4-(trifluoromethyl)cyclohexyl]carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide);5-(difluoromethoxy)-4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoic acid (PubChem CID 158435323) has the molecular formula C109H83ClF16N32O19 and a molecular weight of 2484.49 g/mol. Its IUPAC name is 5-chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-cyclopropyl-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;bis(N-[4,5-difluoro-2-[[4-hydroxy-4-(trifluoromethyl)cyclohexyl]carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide);5-(difluoromethoxy)-4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoic acid.

Molecular Properties

Compound Name5-chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-cyclopropyl-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;bis(N-[4,5-difluoro-2-[[4-hydroxy-4-(trifluoromethyl)cyclohexyl]carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide);5-(difluoromethoxy)-4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoic acid
PubChem CID158435323
Molecular FormulaC109H83ClF16N32O19
Molecular Weight2484.49 g/mol
Exact Mass2482.59
IUPAC Name5-chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-cyclopropyl-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;bis(N-[4,5-difluoro-2-[[4-hydroxy-4-(trifluoromethyl)cyclohexyl]carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide);5-(difluoromethoxy)-4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoic acid
SMILESO=C(Nc1cc(C(F)(F)F)ccc1C(=O)O)c1ccc(-n2ccnc2)nn1.O=C(Nc1cc(F)c(F)cc1C(=O)NC1CCC(O)(C(F)(F)F)CC1)c1ccc(-n2ccnc2)nn1.O=C(Nc1cc(F)c(F)cc1C(=O)NC1CCC(O)(C(F)(F)F)CC1)c1ccc(-n2ccnc2)nn1.O=C(Nc1cc(F)c(OC(F)F)cc1C(=O)O)c1ccc(-n2ccnc2)nn1.O=C(Nc1ccc(C2CC2)cc1C(=O)O)c1ccc(-n2ccnc2)nn1.O=C(Nc1ccc(Cl)cc1C(=O)O)c1ccc(-n2ccnc2)nn1
InChIInChI=1S/2C22H19F5N6O3.C18H15N5O3.C16H10F3N5O4.C16H10F3N5O3.C15H10ClN5O3/c2*23-14-9-13(19(34)29-12-3-5-21(36,6-4-12)22(25,26)27)17(10-15(14)24)30-20(35)16-1-2-18(32-31-16)33-8-7-28-11-33;24-17(15-5-6-16(22-21-15)23-8-7-19-10-23)20-14-4-3-12(11-1-2-11)9-13(14)18(25)26;17-9-6-11(8(15(26)27)5-12(9)28-16(18)19)21-14(25)10-1-2-13(23-22-10)24-4-3-20-7-24;17-16(18,19)9-1-2-10(15(26)27)12(7-9)21-14(25)11-3-4-13(23-22-11)24-6-5-20-8-24;16-9-1-2-11(10(7-9)15(23)24)18-14(22)12-3-4-13(20-19-12)21-6-5-17-8-21/h2*1-2,7-12,36H,3-6H2,(H,29,34)(H,30,35);3-11H,1-2H2,(H,20,24)(H,25,26);1-7,16H,(H,21,25)(H,26,27);1-8H,(H,21,25)(H,26,27);1-8H,(H,18,22)(H,23,24)
InChIKeyHCDQNARGGSQLSH-UHFFFAOYSA-N
XLogP16.06
TPSA693.29 Ų
H-Bond Donors14
H-Bond Acceptors39
Rotatable Bonds29
Heavy Atoms177
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002484.49
LogP ≤ 516.06
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1039

Analyze 5-chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-cyclopropyl-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;bis(N-[4,5-difluoro-2-[[4-hydroxy-4-(trifluoromethyl)cyclohexyl]carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide);5-(difluoromethoxy)-4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoic acid with MolForge

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Related Compounds

N-(2-amino-4,5-difluorophenyl)-6-imidazol-1-ylpyridazine-3-carboxamide;N-[4,5-difluoro-2-[hydroxy(methyl)carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide;ethyl 3,6-difluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoate;ethyl 3,4,6-trifluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoate;4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-5-(trifluoromethoxy)benzoic acid;methyl 6-cyclopropyl-5-fluoro-3-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]pyridine-2-carboxylate
CID 157102397
5-Chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-cyclopropyl-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-(difluoromethoxy)-4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-methylbenzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-methylbenzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoic acid
CID 157527933
4,5-dichloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;4,5-difluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;N-[2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-5-methyl-4-(trifluoromethyl)benzoic acid;methyl 2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-methoxybenzoate;methyl 2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-5-methylbenzoate
CID 157724411
6,7-Difluoro-2-(6-imidazol-1-ylpyridazin-3-yl)-3,1-benzoxazin-4-one;ethyl 3-[2-(6-imidazol-1-ylpyridazin-3-yl)-2-oxoethyl]-6-methylpyridine-2-carboxylate;methyl 4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-5-methoxybenzoate;methyl 2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoate;methyl 2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-5-(trifluoromethyl)benzoate;propan-2-yl 4,5-difluoro-2-[2-(6-imidazol-1-ylpyridazin-3-yl)-2-oxoethyl]benzoate;propan-2-yl 5-fluoro-2-[2-(6-imidazol-1-ylpyridazin-3-yl)-2-oxoethyl]benzoate
CID 158918097
N-[4,5-difluoro-2-[hydroxy(methyl)carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide;ethyl 3-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]naphthalene-2-carboxylate;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-5-methoxybenzoic acid;3-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]quinoline-2-carboxylic acid;methyl 5-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-methylbenzoate;methyl 3-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-5-(trifluoromethyl)pyridine-2-carboxylate
CID 160386410
N-(2-amino-4,5-difluorophenyl)-6-imidazol-1-ylpyridazine-3-carboxamide;N-[4,5-difluoro-2-[hydroxy(methyl)carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide;ethyl 3,6-difluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoate;4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-5-(trifluoromethoxy)benzoic acid;methyl 6-cyclopropyl-5-fluoro-3-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]pyridine-2-carboxylate;methyl 4-fluoro-5-hydroxy-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoate
CID 160572038
CID 160572793
CID 160572793
4,5-dichloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;4,5-difluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;6-imidazol-1-yl-N-[2-(1,1,1,3,3-pentafluoro-2-hydroxybutan-2-yl)phenyl]pyridazine-3-carboxamide;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-5-methyl-4-(trifluoromethyl)benzoic acid;methyl 5-chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoate;methyl 4,5-difluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoate;methyl 2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-methoxybenzoate;methyl 2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-5-methylbenzoate
CID 160975533
(E)-3-[5-chloro-2-(tetrazol-1-yl)phenyl]-1-[2-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]-3-phenylpiperidin-1-yl]prop-2-en-1-one;4-[2-[1-[(E)-3-[5-chloro-2-(tetrazol-1-yl)phenyl]prop-2-enoyl]-3-(2,4-difluorophenyl)piperidin-2-yl]-2-oxoethyl]benzoic acid;3-[2-[1-[(E)-3-[5-chloro-2-(tetrazol-1-yl)phenyl]prop-2-enoyl]-3-phenylpiperidin-2-yl]-1H-imidazol-5-yl]benzonitrile;4-[2-[1-[(E)-3-[5-chloro-2-(tetrazol-1-yl)phenyl]prop-2-enoyl]-3-[3-(trifluoromethyl)phenyl]piperidin-2-yl]-2-oxoethyl]benzoic acid
CID 161187638
6,7-Difluoro-2-(6-imidazol-1-ylpyridazin-3-yl)-3,1-benzoxazin-4-one;ethyl 3-[2-(6-imidazol-1-ylpyridazin-3-yl)-2-oxoethyl]-6-methylpyridine-2-carboxylate;methyl 4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-5-methoxybenzoate;methyl 2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoate;methyl 2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-5-(trifluoromethyl)benzoate;propan-2-yl 5-fluoro-2-[2-(6-imidazol-1-ylpyridazin-3-yl)-2-oxoethyl]benzoate
CID 161193587
N-[4,5-difluoro-2-[hydroxy(methyl)carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide;ethyl 3-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]naphthalene-2-carboxylate;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-5-methoxybenzoic acid;3-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]quinoline-2-carboxylic acid;methyl 5-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-6-methylpyridine-3-carboxylate;methyl 3-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-5-(trifluoromethyl)pyridine-2-carboxylate
CID 161356203
CID 161750943
CID 161750943

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-cyclopropyl-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;bis(N-[4,5-difluoro-2-[[4-hydroxy-4-(trifluoromethyl)cyclohexyl]carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide);5-(difluoromethoxy)-4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoic acid?
The IUPAC name of 5-chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-cyclopropyl-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;bis(N-[4,5-difluoro-2-[[4-hydroxy-4-(trifluoromethyl)cyclohexyl]carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide);5-(difluoromethoxy)-4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoic acid (CID 158435323) is 5-chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-cyclopropyl-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;bis(N-[4,5-difluoro-2-[[4-hydroxy-4-(trifluoromethyl)cyclohexyl]carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide);5-(difluoromethoxy)-4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoic acid.
What is the SMILES notation for 5-chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-cyclopropyl-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;bis(N-[4,5-difluoro-2-[[4-hydroxy-4-(trifluoromethyl)cyclohexyl]carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide);5-(difluoromethoxy)-4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoic acid?
The canonical SMILES for 5-chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-cyclopropyl-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;bis(N-[4,5-difluoro-2-[[4-hydroxy-4-(trifluoromethyl)cyclohexyl]carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide);5-(difluoromethoxy)-4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoic acid is O=C(Nc1cc(C(F)(F)F)ccc1C(=O)O)c1ccc(-n2ccnc2)nn1.O=C(Nc1cc(F)c(F)cc1C(=O)NC1CCC(O)(C(F)(F)F)CC1)c1ccc(-n2ccnc2)nn1.O=C(Nc1cc(F)c(F)cc1C(=O)NC1CCC(O)(C(F)(F)F)CC1)c1ccc(-n2ccnc2)nn1.O=C(Nc1cc(F)c(OC(F)F)cc1C(=O)O)c1ccc(-n2ccnc2)nn1.O=C(Nc1ccc(C2CC2)cc1C(=O)O)c1ccc(-n2ccnc2)nn1.O=C(Nc1ccc(Cl)cc1C(=O)O)c1ccc(-n2ccnc2)nn1.
What is the InChIKey of 5-chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-cyclopropyl-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;bis(N-[4,5-difluoro-2-[[4-hydroxy-4-(trifluoromethyl)cyclohexyl]carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide);5-(difluoromethoxy)-4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoic acid?
The InChIKey is HCDQNARGGSQLSH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C22H19F5N6O3.C18H15N5O3.C16H10F3N5O4.C16H10F3N5O3.C15H10ClN5O3/c2*23-14-9-13(19(34)29-12-3-5-21(36,6-4-12)22(25,26)27)17(10-15(14)24)30-20(35)16-1-2-18(32-31-16)33-8-7-28-11-33;24-17(15-5-6-16(22-21-15)23-8-7-19-10-23)20-14-4-3-12(11-1-2-11)9-13(14)18(25)26;17-9-6-11(8(15(26)27)5-12(9)28-16(18)19)21-14(25)10-1-2-13(23-22-10)24-4-3-20-7-24;17-16(18,19)9-1-2-10(15(26)27)12(7-9)21-14(25)11-3-4-13(23-22-11)24-6-5-20-8-24;16-9-1-2-11(10(7-9)15(23)24)18-14(22)12-3-4-13(20-19-12)21-6-5-17-8-21/h2*1-2,7-12,36H,3-6H2,(H,29,34)(H,30,35);3-11H,1-2H2,(H,20,24)(H,25,26);1-7,16H,(H,21,25)(H,26,27);1-8H,(H,21,25)(H,26,27);1-8H,(H,18,22)(H,23,24).
What are the key properties of 5-chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-cyclopropyl-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;bis(N-[4,5-difluoro-2-[[4-hydroxy-4-(trifluoromethyl)cyclohexyl]carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide);5-(difluoromethoxy)-4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoic acid?
5-chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-cyclopropyl-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;bis(N-[4,5-difluoro-2-[[4-hydroxy-4-(trifluoromethyl)cyclohexyl]carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide);5-(difluoromethoxy)-4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoic acid has a molecular weight of 2484.49 g/mol, XLogP of 16.06, 29 rotatable bonds, 14 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;5-cyclopropyl-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;bis(N-[4,5-difluoro-2-[[4-hydroxy-4-(trifluoromethyl)cyclohexyl]carbamoyl]phenyl]-6-imidazol-1-ylpyridazine-3-carboxamide);5-(difluoromethoxy)-4-fluoro-2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]benzoic acid;2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]-4-(trifluoromethyl)benzoic acid is sourced from PubChem (CID 158435323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).