(1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-3-[2-amino-3-(trifluoromethyl)pentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide;(1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;tert-butyl N-[1-[(1R,2S,5S)-2-[[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]carbamoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl]-1-oxo-3-(trifluoromethyl)pentan-2-yl]carbamate;(1R,2S,5S)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;N,N-diethylethanamine;1-methoxy-N-(triethylazaniumyl)sulfonylmethanimidate;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate;dihydrochloride

C111H167Cl2F24N23O26S — CID 165103471

About (1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-3-[2-amino-3-(trifluoromethyl)pentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide;(1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;tert-butyl N-[1-[(1R,2S,5S)-2-[[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]carbamoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl]-1-oxo-3-(trifluoromethyl)pentan-2-yl]carbamate;(1R,2S,5S)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;N,N-diethylethanamine;1-methoxy-N-(triethylazaniumyl)sulfonylmethanimidate;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate;dihydrochloride

(1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-3-[2-amino-3-(trifluoromethyl)pentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide;(1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;tert-butyl N-[1-[(1R,2S,5S)-2-[[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]carbamoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl]-1-oxo-3-(trifluoromethyl)pentan-2-yl]carbamate;(1R,2S,5S)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;N,N-diethylethanamine;1-methoxy-N-(triethylazaniumyl)sulfonylmethanimidate;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate;dihydrochloride (PubChem CID 165103471) has the molecular formula C111H167Cl2F24N23O26S and a molecular weight of 2798.62 g/mol. Its IUPAC name is (1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-3-[2-amino-3-(trifluoromethyl)pentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide;(1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;tert-butyl N-[1-[(1R,2S,5S)-2-[[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]carbamoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl]-1-oxo-3-(trifluoromethyl)pentan-2-yl]carbamate;(1R,2S,5S)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;N,N-diethylethanamine;1-methoxy-N-(triethylazaniumyl)sulfonylmethanimidate;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate;dihydrochloride.

Molecular Properties

• Compound Name: (1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-3-[2-amino-3-(trifluoromethyl)pentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide;(1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;tert-butyl N-[1-[(1R,2S,5S)-2-[[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]carbamoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl]-1-oxo-3-(trifluoromethyl)pentan-2-yl]carbamate;(1R,2S,5S)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;N,N-diethylethanamine;1-methoxy-N-(triethylazaniumyl)sulfonylmethanimidate;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate;dihydrochloride
• PubChem CID: 165103471
• Molecular Formula: C111H167Cl2F24N23O26S
• Molecular Weight: 2798.62 g/mol
• Exact Mass: 2796.12
• IUPAC Name: (1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-3-[2-amino-3-(trifluoromethyl)pentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide;(1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;tert-butyl N-[1-[(1R,2S,5S)-2-[[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]carbamoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl]-1-oxo-3-(trifluoromethyl)pentan-2-yl]carbamate;(1R,2S,5S)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;N,N-diethylethanamine;1-methoxy-N-(triethylazaniumyl)sulfonylmethanimidate;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate;dihydrochloride
• SMILES: CCC(C(N)C(=O)N1C[C@H]2[C@@H]([C@H]1C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(N)=O)C2(C)C)C(F)(F)F.CCC(C(NC(=O)C(F)(F)F)C(=O)N1C[C@H]2[C@@H]([C@H]1C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(N)=O)C2(C)C)C(F)(F)F.CCC(C(NC(=O)C(F)(F)F)C(=O)N1C[C@H]2[C@@H]([C@H]1C(=O)N[C@H](C#N)C[C@@H]1CCNC1=O)C2(C)C)C(F)(F)F.CCC(C(NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2[C@@H]([C@H]1C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(N)=O)C2(C)C)C(F)(F)F.CCN(CC)CC.CC[N+](CC)(CC)S(=O)(=O)N=C([O-])OC.Cl.Cl.O=C(OC(=O)C(F)(F)F)C(F)(F)F
• InChI: InChI=1S/C26H40F3N5O6.C23H31F6N5O5.C23H29F6N5O4.C21H32F3N5O4.C8H18N2O4S.C6H15N.C4F6O3.2ClH/c1-7-13(26(27,28)29)17(33-23(39)40-24(2,3)4)22(38)34-11-14-16(25(14,5)6)18(34)21(37)32-15(19(30)35)10-12-8-9-31-20(12)36;1-4-10(22(24,25)26)14(33-20(39)23(27,28)29)19(38)34-8-11-13(21(11,2)3)15(34)18(37)32-12(16(30)35)7-9-5-6-31-17(9)36;1-4-12(22(24,25)26)15(33-20(38)23(27,28)29)19(37)34-9-13-14(21(13,2)3)16(34)18(36)32-11(8-30)7-10-5-6-31-17(10)35;1-4-10(21(22,23)24)14(25)19(33)29-8-11-13(20(11,2)3)15(29)18(32)28-12(16(26)30)7-9-5-6-27-17(9)31;1-5-10(6-2,7-3)15(12,13)9-8(11)14-4;1-4-7(5-2)6-3;5-3(6,7)1(11)13-2(12)4(8,9)10;;/h12-18H,7-11H2,1-6H3,(H2,30,35)(H,31,36)(H,32,37)(H,33,39);9-15H,4-8H2,1-3H3,(H2,30,35)(H,31,36)(H,32,37)(H,33,39);10-16H,4-7,9H2,1-3H3,(H,31,35)(H,32,36)(H,33,38);9-15H,4-8,25H2,1-3H3,(H2,26,30)(H,27,31)(H,28,32);5-7H2,1-4H3;4-6H2,1-3H3;;2*1H/t12-,13?,14-,15-,16-,17?,18-;9-,10?,11-,12-,13-,14?,15-;10-,11-,12?,13-,14-,15?,16-;9-,10?,11-,12-,13-,14?,15-;;;;;/m0000...../s1
• InChIKey: WHODFQCBVBUXDJ-XEQKAMRQSA-N
• XLogP: 6.41
• TPSA: 715.05 Ų
• H-Bond Donors: 15
• H-Bond Acceptors: 29
• Rotatable Bonds: 42
• Heavy Atoms: 187
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2798.62
LogP ≤ 5	6.41
H-Bond Donors ≤ 5	15
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-3-[2-amino-3-(trifluoromethyl)pentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide;(1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;tert-butyl N-[1-[(1R,2S,5S)-2-[[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]carbamoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl]-1-oxo-3-(trifluoromethyl)pentan-2-yl]carbamate;(1R,2S,5S)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;N,N-diethylethanamine;1-methoxy-N-(triethylazaniumyl)sulfonylmethanimidate;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate;dihydrochloride?

The IUPAC name of (1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-3-[2-amino-3-(trifluoromethyl)pentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide;(1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;tert-butyl N-[1-[(1R,2S,5S)-2-[[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]carbamoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl]-1-oxo-3-(trifluoromethyl)pentan-2-yl]carbamate;(1R,2S,5S)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;N,N-diethylethanamine;1-methoxy-N-(triethylazaniumyl)sulfonylmethanimidate;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate;dihydrochloride (CID 165103471) is (1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-3-[2-amino-3-(trifluoromethyl)pentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide;(1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;tert-butyl N-[1-[(1R,2S,5S)-2-[[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]carbamoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl]-1-oxo-3-(trifluoromethyl)pentan-2-yl]carbamate;(1R,2S,5S)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;N,N-diethylethanamine;1-methoxy-N-(triethylazaniumyl)sulfonylmethanimidate;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate;dihydrochloride.

What is the SMILES notation for (1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-3-[2-amino-3-(trifluoromethyl)pentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide;(1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;tert-butyl N-[1-[(1R,2S,5S)-2-[[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]carbamoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl]-1-oxo-3-(trifluoromethyl)pentan-2-yl]carbamate;(1R,2S,5S)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;N,N-diethylethanamine;1-methoxy-N-(triethylazaniumyl)sulfonylmethanimidate;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate;dihydrochloride?

The canonical SMILES for (1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-3-[2-amino-3-(trifluoromethyl)pentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide;(1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;tert-butyl N-[1-[(1R,2S,5S)-2-[[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]carbamoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl]-1-oxo-3-(trifluoromethyl)pentan-2-yl]carbamate;(1R,2S,5S)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;N,N-diethylethanamine;1-methoxy-N-(triethylazaniumyl)sulfonylmethanimidate;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate;dihydrochloride is CCC(C(N)C(=O)N1C[C@H]2[C@@H]([C@H]1C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(N)=O)C2(C)C)C(F)(F)F.CCC(C(NC(=O)C(F)(F)F)C(=O)N1C[C@H]2[C@@H]([C@H]1C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(N)=O)C2(C)C)C(F)(F)F.CCC(C(NC(=O)C(F)(F)F)C(=O)N1C[C@H]2[C@@H]([C@H]1C(=O)N[C@H](C#N)C[C@@H]1CCNC1=O)C2(C)C)C(F)(F)F.CCC(C(NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2[C@@H]([C@H]1C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(N)=O)C2(C)C)C(F)(F)F.CCN(CC)CC.CC[N+](CC)(CC)S(=O)(=O)N=C([O-])OC.Cl.Cl.O=C(OC(=O)C(F)(F)F)C(F)(F)F.

What is the InChIKey of (1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-3-[2-amino-3-(trifluoromethyl)pentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide;(1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;tert-butyl N-[1-[(1R,2S,5S)-2-[[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]carbamoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl]-1-oxo-3-(trifluoromethyl)pentan-2-yl]carbamate;(1R,2S,5S)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;N,N-diethylethanamine;1-methoxy-N-(triethylazaniumyl)sulfonylmethanimidate;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate;dihydrochloride?

The InChIKey is WHODFQCBVBUXDJ-XEQKAMRQSA-N. The full InChI is InChI=1S/C26H40F3N5O6.C23H31F6N5O5.C23H29F6N5O4.C21H32F3N5O4.C8H18N2O4S.C6H15N.C4F6O3.2ClH/c1-7-13(26(27,28)29)17(33-23(39)40-24(2,3)4)22(38)34-11-14-16(25(14,5)6)18(34)21(37)32-15(19(30)35)10-12-8-9-31-20(12)36;1-4-10(22(24,25)26)14(33-20(39)23(27,28)29)19(38)34-8-11-13(21(11,2)3)15(34)18(37)32-12(16(30)35)7-9-5-6-31-17(9)36;1-4-12(22(24,25)26)15(33-20(38)23(27,28)29)19(37)34-9-13-14(21(13,2)3)16(34)18(36)32-11(8-30)7-10-5-6-31-17(10)35;1-4-10(21(22,23)24)14(25)19(33)29-8-11-13(20(11,2)3)15(29)18(32)28-12(16(26)30)7-9-5-6-27-17(9)31;1-5-10(6-2,7-3)15(12,13)9-8(11)14-4;1-4-7(5-2)6-3;5-3(6,7)1(11)13-2(12)4(8,9)10;;/h12-18H,7-11H2,1-6H3,(H2,30,35)(H,31,36)(H,32,37)(H,33,39);9-15H,4-8H2,1-3H3,(H2,30,35)(H,31,36)(H,32,37)(H,33,39);10-16H,4-7,9H2,1-3H3,(H,31,35)(H,32,36)(H,33,38);9-15H,4-8,25H2,1-3H3,(H2,26,30)(H,27,31)(H,28,32);5-7H2,1-4H3;4-6H2,1-3H3;;2*1H/t12-,13?,14-,15-,16-,17?,18-;9-,10?,11-,12-,13-,14?,15-;10-,11-,12?,13-,14-,15?,16-;9-,10?,11-,12-,13-,14?,15-;;;;;/m0000...../s1.

What are the key properties of (1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-3-[2-amino-3-(trifluoromethyl)pentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide;(1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;tert-butyl N-[1-[(1R,2S,5S)-2-[[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]carbamoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl]-1-oxo-3-(trifluoromethyl)pentan-2-yl]carbamate;(1R,2S,5S)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;N,N-diethylethanamine;1-methoxy-N-(triethylazaniumyl)sulfonylmethanimidate;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate;dihydrochloride?

(1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-3-[2-amino-3-(trifluoromethyl)pentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide;(1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;tert-butyl N-[1-[(1R,2S,5S)-2-[[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]carbamoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl]-1-oxo-3-(trifluoromethyl)pentan-2-yl]carbamate;(1R,2S,5S)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;N,N-diethylethanamine;1-methoxy-N-(triethylazaniumyl)sulfonylmethanimidate;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate;dihydrochloride has a molecular weight of 2798.62 g/mol, XLogP of 6.41, 42 rotatable bonds, 15 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for (1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-3-[2-amino-3-(trifluoromethyl)pentanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide;(1R,2S,5S)-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;tert-butyl N-[1-[(1R,2S,5S)-2-[[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]carbamoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl]-1-oxo-3-(trifluoromethyl)pentan-2-yl]carbamate;(1R,2S,5S)-N-[(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-6,6-dimethyl-3-[2-[(2,2,2-trifluoroacetyl)amino]-3-(trifluoromethyl)pentanoyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide;N,N-diethylethanamine;1-methoxy-N-(triethylazaniumyl)sulfonylmethanimidate;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate;dihydrochloride is sourced from PubChem (CID 165103471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).