(2S,4R)-1-[(2S)-2-[4-[2-[(2R)-1-[[3-[[6-[3-[4-(dimethylamino)butoxy]-5-propoxyphenoxy]-1,3-dimethyl-2-oxobenzimidazol-5-yl]sulfamoyl]benzoyl]amino]propan-2-yl]oxy-4-pyridinyl]pyrazol-1-yl]-3-methylbutanoyl]-4-methyl-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide;1-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]benzoyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]piperidine-4-carboxamide;4-[3-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]phenyl]-3-oxopropyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]benzamide

C180H208N20O30S6 — CID 158123530

About (2S,4R)-1-[(2S)-2-[4-[2-[(2R)-1-[[3-[[6-[3-[4-(dimethylamino)butoxy]-5-propoxyphenoxy]-1,3-dimethyl-2-oxobenzimidazol-5-yl]sulfamoyl]benzoyl]amino]propan-2-yl]oxy-4-pyridinyl]pyrazol-1-yl]-3-methylbutanoyl]-4-methyl-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide;1-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]benzoyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]piperidine-4-carboxamide;4-[3-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]phenyl]-3-oxopropyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]benzamide

(2S,4R)-1-[(2S)-2-[4-[2-[(2R)-1-[[3-[[6-[3-[4-(dimethylamino)butoxy]-5-propoxyphenoxy]-1,3-dimethyl-2-oxobenzimidazol-5-yl]sulfamoyl]benzoyl]amino]propan-2-yl]oxy-4-pyridinyl]pyrazol-1-yl]-3-methylbutanoyl]-4-methyl-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide;1-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]benzoyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]piperidine-4-carboxamide;4-[3-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]phenyl]-3-oxopropyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]benzamide (PubChem CID 158123530) has the molecular formula C180H208N20O30S6 and a molecular weight of 3324.16 g/mol. Its IUPAC name is (2S,4R)-1-[(2S)-2-[4-[2-[(2R)-1-[[3-[[6-[3-[4-(dimethylamino)butoxy]-5-propoxyphenoxy]-1,3-dimethyl-2-oxobenzimidazol-5-yl]sulfamoyl]benzoyl]amino]propan-2-yl]oxy-4-pyridinyl]pyrazol-1-yl]-3-methylbutanoyl]-4-methyl-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide;1-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]benzoyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]piperidine-4-carboxamide;4-[3-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]phenyl]-3-oxopropyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]benzamide.

Molecular Properties

• Compound Name: (2S,4R)-1-[(2S)-2-[4-[2-[(2R)-1-[[3-[[6-[3-[4-(dimethylamino)butoxy]-5-propoxyphenoxy]-1,3-dimethyl-2-oxobenzimidazol-5-yl]sulfamoyl]benzoyl]amino]propan-2-yl]oxy-4-pyridinyl]pyrazol-1-yl]-3-methylbutanoyl]-4-methyl-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide;1-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]benzoyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]piperidine-4-carboxamide;4-[3-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]phenyl]-3-oxopropyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]benzamide
• PubChem CID: 158123530
• Molecular Formula: C180H208N20O30S6
• Molecular Weight: 3324.16 g/mol
• Exact Mass: 3321.37
• IUPAC Name: (2S,4R)-1-[(2S)-2-[4-[2-[(2R)-1-[[3-[[6-[3-[4-(dimethylamino)butoxy]-5-propoxyphenoxy]-1,3-dimethyl-2-oxobenzimidazol-5-yl]sulfamoyl]benzoyl]amino]propan-2-yl]oxy-4-pyridinyl]pyrazol-1-yl]-3-methylbutanoyl]-4-methyl-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide;1-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]benzoyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]piperidine-4-carboxamide;4-[3-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]phenyl]-3-oxopropyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]benzamide
• SMILES: CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2cccc(C(=O)NC[C@@H](C)Oc4cc(-c5cnn([C@H](C(=O)N6C[C@H](C)C[C@H]6C(=O)N[C@@H](C)c6ccc(-c7scnc7C)cc6)C(C)C)c5)ccn4)c2)n(C)c(=O)n3C)c1.CCCOc1cccc(Oc2cc3c(cc2CS(=O)(=O)c2cccc(C(=O)CCc4ccc(C(=O)N[C@H](C(=O)N5C[C@H](O)C[C@H]5C(=O)CCc5ccc(-c6sccc6C)cc5)C(C)(C)C)cc4)c2)n(C)c(=O)n3C)c1.CCCOc1cccc(Oc2cc3c(cc2CS(=O)(=O)c2cccc(C(=O)N4CCC(C(=O)N[C@H](C(=O)N5C[C@H](O)C[C@H]5C(=O)CCc5ccc(-c6sccc6C)cc5)C(C)(C)C)CC4)c2)n(C)c(=O)n3C)c1
• InChI: InChI=1S/C65H79N11O10S2.C59H64N4O10S2.C56H65N5O10S2/c1-12-25-83-50-30-51(84-26-14-13-24-72(8)9)32-52(31-50)86-58-34-56-55(73(10)65(80)74(56)11)33-54(58)71-88(81,82)53-17-15-16-48(28-53)62(77)67-35-42(5)85-59-29-47(22-23-66-59)49-36-69-76(38-49)60(40(2)3)64(79)75-37-41(4)27-57(75)63(78)70-43(6)45-18-20-46(21-19-45)61-44(7)68-39-87-61;1-8-28-72-45-12-10-13-46(33-45)73-53-34-49-48(61(6)58(69)62(49)7)31-43(53)36-75(70,71)47-14-9-11-42(30-47)51(65)25-19-39-17-23-41(24-18-39)56(67)60-55(59(3,4)5)57(68)63-35-44(64)32-50(63)52(66)26-20-38-15-21-40(22-16-38)54-37(2)27-29-74-54;1-8-26-70-42-12-10-13-43(31-42)71-49-32-46-45(58(6)55(67)59(46)7)29-40(49)34-73(68,69)44-14-9-11-39(28-44)53(65)60-24-21-38(22-25-60)52(64)57-51(56(3,4)5)54(66)61-33-41(62)30-47(61)48(63)20-17-36-15-18-37(19-16-36)50-35(2)23-27-72-50/h15-23,28-34,36,38-43,57,60,71H,12-14,24-27,35,37H2,1-11H3,(H,67,77)(H,70,78);9-18,21-24,27,29-31,33-34,44,50,55,64H,8,19-20,25-26,28,32,35-36H2,1-7H3,(H,60,67);9-16,18-19,23,27-29,31-32,38,41,47,51,62H,8,17,20-22,24-26,30,33-34H2,1-7H3,(H,57,64)/t41-,42-,43+,57+,60+;44-,50+,55-;41-,47+,51-/m111/s1
• InChIKey: FRWPZJOASDDXDQ-PPZBBSIJSA-N
• XLogP: 27.79
• TPSA: 605.23 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 44
• Rotatable Bonds: 64
• Heavy Atoms: 236
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3324.16
LogP ≤ 5	27.79
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	44

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (2S,4R)-1-[(2S)-2-[4-[2-[(2R)-1-[[3-[[6-[3-[4-(dimethylamino)butoxy]-5-propoxyphenoxy]-1,3-dimethyl-2-oxobenzimidazol-5-yl]sulfamoyl]benzoyl]amino]propan-2-yl]oxy-4-pyridinyl]pyrazol-1-yl]-3-methylbutanoyl]-4-methyl-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide;1-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]benzoyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]piperidine-4-carboxamide;4-[3-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]phenyl]-3-oxopropyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]benzamide?

The IUPAC name of (2S,4R)-1-[(2S)-2-[4-[2-[(2R)-1-[[3-[[6-[3-[4-(dimethylamino)butoxy]-5-propoxyphenoxy]-1,3-dimethyl-2-oxobenzimidazol-5-yl]sulfamoyl]benzoyl]amino]propan-2-yl]oxy-4-pyridinyl]pyrazol-1-yl]-3-methylbutanoyl]-4-methyl-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide;1-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]benzoyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]piperidine-4-carboxamide;4-[3-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]phenyl]-3-oxopropyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]benzamide (CID 158123530) is (2S,4R)-1-[(2S)-2-[4-[2-[(2R)-1-[[3-[[6-[3-[4-(dimethylamino)butoxy]-5-propoxyphenoxy]-1,3-dimethyl-2-oxobenzimidazol-5-yl]sulfamoyl]benzoyl]amino]propan-2-yl]oxy-4-pyridinyl]pyrazol-1-yl]-3-methylbutanoyl]-4-methyl-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide;1-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]benzoyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]piperidine-4-carboxamide;4-[3-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]phenyl]-3-oxopropyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]benzamide.

What is the SMILES notation for (2S,4R)-1-[(2S)-2-[4-[2-[(2R)-1-[[3-[[6-[3-[4-(dimethylamino)butoxy]-5-propoxyphenoxy]-1,3-dimethyl-2-oxobenzimidazol-5-yl]sulfamoyl]benzoyl]amino]propan-2-yl]oxy-4-pyridinyl]pyrazol-1-yl]-3-methylbutanoyl]-4-methyl-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide;1-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]benzoyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]piperidine-4-carboxamide;4-[3-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]phenyl]-3-oxopropyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]benzamide?

The canonical SMILES for (2S,4R)-1-[(2S)-2-[4-[2-[(2R)-1-[[3-[[6-[3-[4-(dimethylamino)butoxy]-5-propoxyphenoxy]-1,3-dimethyl-2-oxobenzimidazol-5-yl]sulfamoyl]benzoyl]amino]propan-2-yl]oxy-4-pyridinyl]pyrazol-1-yl]-3-methylbutanoyl]-4-methyl-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide;1-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]benzoyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]piperidine-4-carboxamide;4-[3-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]phenyl]-3-oxopropyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]benzamide is CCCOc1cc(OCCCCN(C)C)cc(Oc2cc3c(cc2NS(=O)(=O)c2cccc(C(=O)NC[C@@H](C)Oc4cc(-c5cnn([C@H](C(=O)N6C[C@H](C)C[C@H]6C(=O)N[C@@H](C)c6ccc(-c7scnc7C)cc6)C(C)C)c5)ccn4)c2)n(C)c(=O)n3C)c1.CCCOc1cccc(Oc2cc3c(cc2CS(=O)(=O)c2cccc(C(=O)CCc4ccc(C(=O)N[C@H](C(=O)N5C[C@H](O)C[C@H]5C(=O)CCc5ccc(-c6sccc6C)cc5)C(C)(C)C)cc4)c2)n(C)c(=O)n3C)c1.CCCOc1cccc(Oc2cc3c(cc2CS(=O)(=O)c2cccc(C(=O)N4CCC(C(=O)N[C@H](C(=O)N5C[C@H](O)C[C@H]5C(=O)CCc5ccc(-c6sccc6C)cc5)C(C)(C)C)CC4)c2)n(C)c(=O)n3C)c1.

What is the InChIKey of (2S,4R)-1-[(2S)-2-[4-[2-[(2R)-1-[[3-[[6-[3-[4-(dimethylamino)butoxy]-5-propoxyphenoxy]-1,3-dimethyl-2-oxobenzimidazol-5-yl]sulfamoyl]benzoyl]amino]propan-2-yl]oxy-4-pyridinyl]pyrazol-1-yl]-3-methylbutanoyl]-4-methyl-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide;1-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]benzoyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]piperidine-4-carboxamide;4-[3-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]phenyl]-3-oxopropyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]benzamide?

The InChIKey is FRWPZJOASDDXDQ-PPZBBSIJSA-N. The full InChI is InChI=1S/C65H79N11O10S2.C59H64N4O10S2.C56H65N5O10S2/c1-12-25-83-50-30-51(84-26-14-13-24-72(8)9)32-52(31-50)86-58-34-56-55(73(10)65(80)74(56)11)33-54(58)71-88(81,82)53-17-15-16-48(28-53)62(77)67-35-42(5)85-59-29-47(22-23-66-59)49-36-69-76(38-49)60(40(2)3)64(79)75-37-41(4)27-57(75)63(78)70-43(6)45-18-20-46(21-19-45)61-44(7)68-39-87-61;1-8-28-72-45-12-10-13-46(33-45)73-53-34-49-48(61(6)58(69)62(49)7)31-43(53)36-75(70,71)47-14-9-11-42(30-47)51(65)25-19-39-17-23-41(24-18-39)56(67)60-55(59(3,4)5)57(68)63-35-44(64)32-50(63)52(66)26-20-38-15-21-40(22-16-38)54-37(2)27-29-74-54;1-8-26-70-42-12-10-13-43(31-42)71-49-32-46-45(58(6)55(67)59(46)7)29-40(49)34-73(68,69)44-14-9-11-39(28-44)53(65)60-24-21-38(22-25-60)52(64)57-51(56(3,4)5)54(66)61-33-41(62)30-47(61)48(63)20-17-36-15-18-37(19-16-36)50-35(2)23-27-72-50/h15-23,28-34,36,38-43,57,60,71H,12-14,24-27,35,37H2,1-11H3,(H,67,77)(H,70,78);9-18,21-24,27,29-31,33-34,44,50,55,64H,8,19-20,25-26,28,32,35-36H2,1-7H3,(H,60,67);9-16,18-19,23,27-29,31-32,38,41,47,51,62H,8,17,20-22,24-26,30,33-34H2,1-7H3,(H,57,64)/t41-,42-,43+,57+,60+;44-,50+,55-;41-,47+,51-/m111/s1.

What are the key properties of (2S,4R)-1-[(2S)-2-[4-[2-[(2R)-1-[[3-[[6-[3-[4-(dimethylamino)butoxy]-5-propoxyphenoxy]-1,3-dimethyl-2-oxobenzimidazol-5-yl]sulfamoyl]benzoyl]amino]propan-2-yl]oxy-4-pyridinyl]pyrazol-1-yl]-3-methylbutanoyl]-4-methyl-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide;1-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]benzoyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]piperidine-4-carboxamide;4-[3-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]phenyl]-3-oxopropyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]benzamide?

(2S,4R)-1-[(2S)-2-[4-[2-[(2R)-1-[[3-[[6-[3-[4-(dimethylamino)butoxy]-5-propoxyphenoxy]-1,3-dimethyl-2-oxobenzimidazol-5-yl]sulfamoyl]benzoyl]amino]propan-2-yl]oxy-4-pyridinyl]pyrazol-1-yl]-3-methylbutanoyl]-4-methyl-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide;1-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]benzoyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]piperidine-4-carboxamide;4-[3-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]phenyl]-3-oxopropyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]benzamide has a molecular weight of 3324.16 g/mol, XLogP of 27.79, 64 rotatable bonds, 7 hydrogen bond donors, and 44 hydrogen bond acceptors.

Where does this data come from?

All data for (2S,4R)-1-[(2S)-2-[4-[2-[(2R)-1-[[3-[[6-[3-[4-(dimethylamino)butoxy]-5-propoxyphenoxy]-1,3-dimethyl-2-oxobenzimidazol-5-yl]sulfamoyl]benzoyl]amino]propan-2-yl]oxy-4-pyridinyl]pyrazol-1-yl]-3-methylbutanoyl]-4-methyl-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide;1-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]benzoyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]piperidine-4-carboxamide;4-[3-[3-[[1,3-dimethyl-2-oxo-6-(3-propoxyphenoxy)benzimidazol-5-yl]methylsulfonyl]phenyl]-3-oxopropyl]-N-[(2S)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(3-methylthiophen-2-yl)phenyl]propanoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]benzamide is sourced from PubChem (CID 158123530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).