4-[[(2S)-2-(3-chloro-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[1-[1-(2-hydroxyethyl)piperidin-4-yl]piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1,4-dioxaspiro[4.5]decan-8-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(4-iminobutyl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1-methoxypropan-2-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one

C119H148Cl4N28O10 — CID 161322018

IUPAC4-[[(2S)-2-(3-chloro-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[1-[1-(2-hydroxyethyl)piperidin-4-yl]piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1,4-dioxaspiro[4.5]decan-8-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(4-iminobutyl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1-methoxypropan-2-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one
SMILESCOCC(C)N1CCC(c2cc(C)c3nc(-c4c(NCCn5cc(Cl)cn5)cc[nH]c4=O)[nH]c3c2)CC1.COc1ccc([C@H](O)CNc2cc[nH]c(=O)c2-c2nc3c(C)cc(C4CCN(C5CCN(CCO)CC5)CC4)cc3[nH]2)cc1Cl.Cc1cc(C2CCN(C3CCC4(CC3)OCCO4)CC2)cc2[nH]c(-c3c(NCCn4cc(Cl)cn4)cc[nH]c3=O)nc12.[H]/N=C/CCCN1CCC(c2cc(C)c3nc(-c4c(NCCn5cc(Cl)cn5)cc[nH]c4=O)[nH]c3c2)CC1
InChIInChI=1S/C34H43ClN6O4.C31H38ClN7O3.C27H33ClN8O.C27H34ClN7O2/c1-21-17-24(22-6-13-41(14-7-22)25-8-11-40(12-9-25)15-16-42)19-28-32(21)39-33(38-28)31-27(5-10-36-34(31)44)37-20-29(43)23-3-4-30(45-2)26(35)18-23;1-20-16-22(21-5-11-38(12-6-21)24-2-7-31(8-3-24)41-14-15-42-31)17-26-28(20)37-29(36-26)27-25(4-9-34-30(27)40)33-10-13-39-19-23(32)18-35-39;1-18-14-20(19-5-11-35(12-6-19)10-3-2-7-29)15-23-25(18)34-26(33-23)24-22(4-8-31-27(24)37)30-9-13-36-17-21(28)16-32-36;1-17-12-20(19-5-9-34(10-6-19)18(2)16-37-3)13-23-25(17)33-26(32-23)24-22(4-7-30-27(24)36)29-8-11-35-15-21(28)14-31-35/h3-5,10,17-19,22,25,29,42-43H,6-9,11-16,20H2,1-2H3,(H,38,39)(H2,36,37,44);4,9,16-19,21,24H,2-3,5-8,10-15H2,1H3,(H,36,37)(H2,33,34,40);4,7-8,14-17,19,29H,2-3,5-6,9-13H2,1H3,(H,33,34)(H2,30,31,37);4,7,12-15,18-19H,5-6,8-11,16H2,1-3H3,(H,32,33)(H2,29,30,36)/b;;29-7+;/t29-;;;/m1.../s1
InChIKeyVKGPSMSONUUXHW-PGYFOVLUSA-N
MW2272.49 g/mol
LogP18.92
Rot. Bonds36

About 4-[[(2S)-2-(3-chloro-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[1-[1-(2-hydroxyethyl)piperidin-4-yl]piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1,4-dioxaspiro[4.5]decan-8-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(4-iminobutyl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1-methoxypropan-2-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one

4-[[(2S)-2-(3-chloro-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[1-[1-(2-hydroxyethyl)piperidin-4-yl]piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1,4-dioxaspiro[4.5]decan-8-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(4-iminobutyl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1-methoxypropan-2-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one (PubChem CID 161322018) has the molecular formula C119H148Cl4N28O10 and a molecular weight of 2272.49 g/mol. Its IUPAC name is 4-[[(2S)-2-(3-chloro-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[1-[1-(2-hydroxyethyl)piperidin-4-yl]piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1,4-dioxaspiro[4.5]decan-8-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(4-iminobutyl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1-methoxypropan-2-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one.

Molecular Properties

Compound Name4-[[(2S)-2-(3-chloro-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[1-[1-(2-hydroxyethyl)piperidin-4-yl]piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1,4-dioxaspiro[4.5]decan-8-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(4-iminobutyl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1-methoxypropan-2-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one
PubChem CID161322018
Molecular FormulaC119H148Cl4N28O10
Molecular Weight2272.49 g/mol
Exact Mass2269.07
IUPAC Name4-[[(2S)-2-(3-chloro-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[1-[1-(2-hydroxyethyl)piperidin-4-yl]piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1,4-dioxaspiro[4.5]decan-8-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(4-iminobutyl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1-methoxypropan-2-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one
SMILESCOCC(C)N1CCC(c2cc(C)c3nc(-c4c(NCCn5cc(Cl)cn5)cc[nH]c4=O)[nH]c3c2)CC1.COc1ccc([C@H](O)CNc2cc[nH]c(=O)c2-c2nc3c(C)cc(C4CCN(C5CCN(CCO)CC5)CC4)cc3[nH]2)cc1Cl.Cc1cc(C2CCN(C3CCC4(CC3)OCCO4)CC2)cc2[nH]c(-c3c(NCCn4cc(Cl)cn4)cc[nH]c3=O)nc12.[H]/N=C/CCCN1CCC(c2cc(C)c3nc(-c4c(NCCn5cc(Cl)cn5)cc[nH]c4=O)[nH]c3c2)CC1
InChIInChI=1S/C34H43ClN6O4.C31H38ClN7O3.C27H33ClN8O.C27H34ClN7O2/c1-21-17-24(22-6-13-41(14-7-22)25-8-11-40(12-9-25)15-16-42)19-28-32(21)39-33(38-28)31-27(5-10-36-34(31)44)37-20-29(43)23-3-4-30(45-2)26(35)18-23;1-20-16-22(21-5-11-38(12-6-21)24-2-7-31(8-3-24)41-14-15-42-31)17-26-28(20)37-29(36-26)27-25(4-9-34-30(27)40)33-10-13-39-19-23(32)18-35-39;1-18-14-20(19-5-11-35(12-6-19)10-3-2-7-29)15-23-25(18)34-26(33-23)24-22(4-8-31-27(24)37)30-9-13-36-17-21(28)16-32-36;1-17-12-20(19-5-9-34(10-6-19)18(2)16-37-3)13-23-25(17)33-26(32-23)24-22(4-7-30-27(24)36)29-8-11-35-15-21(28)14-31-35/h3-5,10,17-19,22,25,29,42-43H,6-9,11-16,20H2,1-2H3,(H,38,39)(H2,36,37,44);4,9,16-19,21,24H,2-3,5-8,10-15H2,1H3,(H,36,37)(H2,33,34,40);4,7-8,14-17,19,29H,2-3,5-6,9-13H2,1H3,(H,33,34)(H2,30,31,37);4,7,12-15,18-19H,5-6,8-11,16H2,1-3H3,(H,32,33)(H2,29,30,36)/b;;29-7+;/t29-;;;/m1.../s1
InChIKeyVKGPSMSONUUXHW-PGYFOVLUSA-N
XLogP18.92
TPSA465.17 Ų
H-Bond Donors15
H-Bond Acceptors30
Rotatable Bonds36
Heavy Atoms161
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002272.49
LogP ≤ 518.92
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 4-[[(2S)-2-(3-chloro-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[1-[1-(2-hydroxyethyl)piperidin-4-yl]piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1,4-dioxaspiro[4.5]decan-8-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(4-iminobutyl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1-methoxypropan-2-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[[(2S)-2-(3-chloro-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[1-[1-(2-hydroxyethyl)piperidin-4-yl]piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1,4-dioxaspiro[4.5]decan-8-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(4-iminobutyl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1-methoxypropan-2-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one?
The IUPAC name of 4-[[(2S)-2-(3-chloro-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[1-[1-(2-hydroxyethyl)piperidin-4-yl]piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1,4-dioxaspiro[4.5]decan-8-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(4-iminobutyl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1-methoxypropan-2-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one (CID 161322018) is 4-[[(2S)-2-(3-chloro-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[1-[1-(2-hydroxyethyl)piperidin-4-yl]piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1,4-dioxaspiro[4.5]decan-8-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(4-iminobutyl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1-methoxypropan-2-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one.
What is the SMILES notation for 4-[[(2S)-2-(3-chloro-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[1-[1-(2-hydroxyethyl)piperidin-4-yl]piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1,4-dioxaspiro[4.5]decan-8-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(4-iminobutyl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1-methoxypropan-2-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one?
The canonical SMILES for 4-[[(2S)-2-(3-chloro-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[1-[1-(2-hydroxyethyl)piperidin-4-yl]piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1,4-dioxaspiro[4.5]decan-8-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(4-iminobutyl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1-methoxypropan-2-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one is COCC(C)N1CCC(c2cc(C)c3nc(-c4c(NCCn5cc(Cl)cn5)cc[nH]c4=O)[nH]c3c2)CC1.COc1ccc([C@H](O)CNc2cc[nH]c(=O)c2-c2nc3c(C)cc(C4CCN(C5CCN(CCO)CC5)CC4)cc3[nH]2)cc1Cl.Cc1cc(C2CCN(C3CCC4(CC3)OCCO4)CC2)cc2[nH]c(-c3c(NCCn4cc(Cl)cn4)cc[nH]c3=O)nc12.[H]/N=C/CCCN1CCC(c2cc(C)c3nc(-c4c(NCCn5cc(Cl)cn5)cc[nH]c4=O)[nH]c3c2)CC1.
What is the InChIKey of 4-[[(2S)-2-(3-chloro-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[1-[1-(2-hydroxyethyl)piperidin-4-yl]piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1,4-dioxaspiro[4.5]decan-8-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(4-iminobutyl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1-methoxypropan-2-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one?
The InChIKey is VKGPSMSONUUXHW-PGYFOVLUSA-N. The full InChI is InChI=1S/C34H43ClN6O4.C31H38ClN7O3.C27H33ClN8O.C27H34ClN7O2/c1-21-17-24(22-6-13-41(14-7-22)25-8-11-40(12-9-25)15-16-42)19-28-32(21)39-33(38-28)31-27(5-10-36-34(31)44)37-20-29(43)23-3-4-30(45-2)26(35)18-23;1-20-16-22(21-5-11-38(12-6-21)24-2-7-31(8-3-24)41-14-15-42-31)17-26-28(20)37-29(36-26)27-25(4-9-34-30(27)40)33-10-13-39-19-23(32)18-35-39;1-18-14-20(19-5-11-35(12-6-19)10-3-2-7-29)15-23-25(18)34-26(33-23)24-22(4-8-31-27(24)37)30-9-13-36-17-21(28)16-32-36;1-17-12-20(19-5-9-34(10-6-19)18(2)16-37-3)13-23-25(17)33-26(32-23)24-22(4-7-30-27(24)36)29-8-11-35-15-21(28)14-31-35/h3-5,10,17-19,22,25,29,42-43H,6-9,11-16,20H2,1-2H3,(H,38,39)(H2,36,37,44);4,9,16-19,21,24H,2-3,5-8,10-15H2,1H3,(H,36,37)(H2,33,34,40);4,7-8,14-17,19,29H,2-3,5-6,9-13H2,1H3,(H,33,34)(H2,30,31,37);4,7,12-15,18-19H,5-6,8-11,16H2,1-3H3,(H,32,33)(H2,29,30,36)/b;;29-7+;/t29-;;;/m1.../s1.
What are the key properties of 4-[[(2S)-2-(3-chloro-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[1-[1-(2-hydroxyethyl)piperidin-4-yl]piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1,4-dioxaspiro[4.5]decan-8-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(4-iminobutyl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1-methoxypropan-2-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one?
4-[[(2S)-2-(3-chloro-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[1-[1-(2-hydroxyethyl)piperidin-4-yl]piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1,4-dioxaspiro[4.5]decan-8-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(4-iminobutyl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1-methoxypropan-2-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one has a molecular weight of 2272.49 g/mol, XLogP of 18.92, 36 rotatable bonds, 15 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(2S)-2-(3-chloro-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[1-[1-(2-hydroxyethyl)piperidin-4-yl]piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1,4-dioxaspiro[4.5]decan-8-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(4-iminobutyl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one;4-[2-(4-chloropyrazol-1-yl)ethylamino]-3-[6-[1-(1-methoxypropan-2-yl)piperidin-4-yl]-4-methyl-1H-benzimidazol-2-yl]-1H-pyridin-2-one is sourced from PubChem (CID 161322018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).