N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidine-1-carbonyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[10-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-10-oxodecanoyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[2-[4-[[7-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-7-oxoheptyl]carbamoyl]phenyl]-2-oxoethyl]-6,6-dimethyl-2,4-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide;sulfane

C158H205N29O19S6 — CID 167625390

About N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidine-1-carbonyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[10-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-10-oxodecanoyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[2-[4-[[7-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-7-oxoheptyl]carbamoyl]phenyl]-2-oxoethyl]-6,6-dimethyl-2,4-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide;sulfane

N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidine-1-carbonyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[10-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-10-oxodecanoyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[2-[4-[[7-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-7-oxoheptyl]carbamoyl]phenyl]-2-oxoethyl]-6,6-dimethyl-2,4-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide;sulfane (PubChem CID 167625390) has the molecular formula C158H205N29O19S6 and a molecular weight of 3006.96 g/mol. Its IUPAC name is N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidine-1-carbonyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[10-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-10-oxodecanoyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[2-[4-[[7-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-7-oxoheptyl]carbamoyl]phenyl]-2-oxoethyl]-6,6-dimethyl-2,4-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide;sulfane.

Molecular Properties

• Compound Name: N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidine-1-carbonyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[10-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-10-oxodecanoyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[2-[4-[[7-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-7-oxoheptyl]carbamoyl]phenyl]-2-oxoethyl]-6,6-dimethyl-2,4-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide;sulfane
• PubChem CID: 167625390
• Molecular Formula: C158H205N29O19S6
• Molecular Weight: 3006.96 g/mol
• Exact Mass: 3004.43
• IUPAC Name: N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidine-1-carbonyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[10-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-10-oxodecanoyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[2-[4-[[7-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-7-oxoheptyl]carbamoyl]phenyl]-2-oxoethyl]-6,6-dimethyl-2,4-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide;sulfane
• SMILES: Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCCCCC(=O)c2ccc(C(=O)Nc3n[nH]c4c3CN(C(=O)N[C@H](CN(C)C)c3ccccc3)C4(C)C)cc2)C(C)(C)C)cc1.Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCCNC(=O)c2ccc(C(=O)Cc3[nH]nc4c3CN(C(=O)N[C@H](CN(C)C)c3ccccc3)C4(C)C)cc2)C(C)(C)C)cc1.Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)c2ccc(C(=O)Nc3n[nH]c4c3CN(C(=O)N[C@H](CN(C)C)c3ccccc3)C4(C)C)cc2)cc1.S.S.S
• InChI: InChI=1S/C58H76N10O7S.C57H74N10O7S.C43H49N9O5S.3H2S/c1-36(38-23-27-41(28-24-38)49-37(2)59-35-76-49)60-54(73)46-31-43(69)32-67(46)55(74)51(57(3,4)5)62-48(71)22-18-13-11-10-12-17-21-47(70)40-25-29-42(30-26-40)53(72)63-52-44-33-68(58(6,7)50(44)64-65-52)56(75)61-45(34-66(8)9)39-19-15-14-16-20-39;1-35(37-20-24-40(25-21-37)49-36(2)59-34-75-49)60-53(72)46-29-42(68)31-66(46)54(73)51(56(3,4)5)62-48(70)19-15-10-11-16-28-58-52(71)41-26-22-39(23-27-41)47(69)30-44-43-32-67(57(6,7)50(43)64-63-44)55(74)61-45(33-65(8)9)38-17-13-12-14-18-38;1-25(27-12-14-29(15-13-27)36-26(2)44-24-58-36)45-40(55)35-20-32(53)21-51(35)41(56)31-18-16-30(17-19-31)39(54)47-38-33-22-52(43(3,4)37(33)48-49-38)42(57)46-34(23-50(5)6)28-10-8-7-9-11-28;;;/h14-16,19-20,23-30,35-36,43,45-46,51,69H,10-13,17-18,21-22,31-34H2,1-9H3,(H,60,73)(H,61,75)(H,62,71)(H2,63,64,65,72);12-14,17-18,20-27,34-35,42,45-46,51,68H,10-11,15-16,19,28-33H2,1-9H3,(H,58,71)(H,60,72)(H,61,74)(H,62,70)(H,63,64);7-19,24-25,32,34-35,53H,20-23H2,1-6H3,(H,45,55)(H,46,57)(H2,47,48,49,54);3*1H2/t36-,43+,45+,46-,51+;35-,42+,45+,46-,51+;25-,32+,34+,35-;;;/m000.../s1
• InChIKey: NAJWHZUUQMOJDB-IFULIGHSSA-N
• XLogP: 22.16
• TPSA: 620.01 Ų
• H-Bond Donors: 17
• H-Bond Acceptors: 31
• Rotatable Bonds: 54
• Heavy Atoms: 212
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3006.96
LogP ≤ 5	22.16
H-Bond Donors ≤ 5	17
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidine-1-carbonyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[10-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-10-oxodecanoyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[2-[4-[[7-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-7-oxoheptyl]carbamoyl]phenyl]-2-oxoethyl]-6,6-dimethyl-2,4-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide;sulfane?

The IUPAC name of N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidine-1-carbonyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[10-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-10-oxodecanoyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[2-[4-[[7-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-7-oxoheptyl]carbamoyl]phenyl]-2-oxoethyl]-6,6-dimethyl-2,4-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide;sulfane (CID 167625390) is N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidine-1-carbonyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[10-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-10-oxodecanoyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[2-[4-[[7-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-7-oxoheptyl]carbamoyl]phenyl]-2-oxoethyl]-6,6-dimethyl-2,4-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide;sulfane.

What is the SMILES notation for N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidine-1-carbonyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[10-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-10-oxodecanoyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[2-[4-[[7-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-7-oxoheptyl]carbamoyl]phenyl]-2-oxoethyl]-6,6-dimethyl-2,4-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide;sulfane?

The canonical SMILES for N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidine-1-carbonyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[10-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-10-oxodecanoyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[2-[4-[[7-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-7-oxoheptyl]carbamoyl]phenyl]-2-oxoethyl]-6,6-dimethyl-2,4-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide;sulfane is Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCCCCC(=O)c2ccc(C(=O)Nc3n[nH]c4c3CN(C(=O)N[C@H](CN(C)C)c3ccccc3)C4(C)C)cc2)C(C)(C)C)cc1.Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCCNC(=O)c2ccc(C(=O)Cc3[nH]nc4c3CN(C(=O)N[C@H](CN(C)C)c3ccccc3)C4(C)C)cc2)C(C)(C)C)cc1.Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)c2ccc(C(=O)Nc3n[nH]c4c3CN(C(=O)N[C@H](CN(C)C)c3ccccc3)C4(C)C)cc2)cc1.S.S.S.

What is the InChIKey of N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidine-1-carbonyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[10-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-10-oxodecanoyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[2-[4-[[7-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-7-oxoheptyl]carbamoyl]phenyl]-2-oxoethyl]-6,6-dimethyl-2,4-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide;sulfane?

The InChIKey is NAJWHZUUQMOJDB-IFULIGHSSA-N. The full InChI is InChI=1S/C58H76N10O7S.C57H74N10O7S.C43H49N9O5S.3H2S/c1-36(38-23-27-41(28-24-38)49-37(2)59-35-76-49)60-54(73)46-31-43(69)32-67(46)55(74)51(57(3,4)5)62-48(71)22-18-13-11-10-12-17-21-47(70)40-25-29-42(30-26-40)53(72)63-52-44-33-68(58(6,7)50(44)64-65-52)56(75)61-45(34-66(8)9)39-19-15-14-16-20-39;1-35(37-20-24-40(25-21-37)49-36(2)59-34-75-49)60-53(72)46-29-42(68)31-66(46)54(73)51(56(3,4)5)62-48(70)19-15-10-11-16-28-58-52(71)41-26-22-39(23-27-41)47(69)30-44-43-32-67(57(6,7)50(43)64-63-44)55(74)61-45(33-65(8)9)38-17-13-12-14-18-38;1-25(27-12-14-29(15-13-27)36-26(2)44-24-58-36)45-40(55)35-20-32(53)21-51(35)41(56)31-18-16-30(17-19-31)39(54)47-38-33-22-52(43(3,4)37(33)48-49-38)42(57)46-34(23-50(5)6)28-10-8-7-9-11-28;;;/h14-16,19-20,23-30,35-36,43,45-46,51,69H,10-13,17-18,21-22,31-34H2,1-9H3,(H,60,73)(H,61,75)(H,62,71)(H2,63,64,65,72);12-14,17-18,20-27,34-35,42,45-46,51,68H,10-11,15-16,19,28-33H2,1-9H3,(H,58,71)(H,60,72)(H,61,74)(H,62,70)(H,63,64);7-19,24-25,32,34-35,53H,20-23H2,1-6H3,(H,45,55)(H,46,57)(H2,47,48,49,54);3*1H2/t36-,43+,45+,46-,51+;35-,42+,45+,46-,51+;25-,32+,34+,35-;;;/m000.../s1.

What are the key properties of N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidine-1-carbonyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[10-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-10-oxodecanoyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[2-[4-[[7-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-7-oxoheptyl]carbamoyl]phenyl]-2-oxoethyl]-6,6-dimethyl-2,4-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide;sulfane?

N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidine-1-carbonyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[10-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-10-oxodecanoyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[2-[4-[[7-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-7-oxoheptyl]carbamoyl]phenyl]-2-oxoethyl]-6,6-dimethyl-2,4-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide;sulfane has a molecular weight of 3006.96 g/mol, XLogP of 22.16, 54 rotatable bonds, 17 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidine-1-carbonyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[[4-[10-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-10-oxodecanoyl]benzoyl]amino]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide;N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-[2-[4-[[7-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-7-oxoheptyl]carbamoyl]phenyl]-2-oxoethyl]-6,6-dimethyl-2,4-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide;sulfane is sourced from PubChem (CID 167625390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).