lithium;2-[6-bromo-2-[[(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carbonyl]amino]-3-pyridinyl]acetic acid;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-[2-[hex-5-enyl(methyl)amino]-2-oxoethyl]-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-(2-methoxy-2-oxoethyl)-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;ethanol;(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carboxylic acid;methane;methyl 2-(2-amino-6-bromo-3-pyridinyl)acetate;N-methylhex-5-en-1-amine;hydroxide

C105H165Br4LiN14O22 — CID 158500404

IUPAClithium;2-[6-bromo-2-[[(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carbonyl]amino]-3-pyridinyl]acetic acid;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-[2-[hex-5-enyl(methyl)amino]-2-oxoethyl]-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-(2-methoxy-2-oxoethyl)-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;ethanol;(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carboxylic acid;methane;methyl 2-(2-amino-6-bromo-3-pyridinyl)acetate;N-methylhex-5-en-1-amine;hydroxide
SMILESC.C.C.C.C.C.C.C=CCCCCN(C)C(=O)Cc1ccc(Br)nc1NC(=O)[C@@H]1C[C@@]2(C=C)C[C@H]2N1C(=O)OC(C)(C)C.C=CCCCCNC.C=C[C@@]12C[C@@H](C(=O)Nc3nc(Br)ccc3CC(=O)O)N(C(=O)OC(C)(C)C)[C@@H]1C2.C=C[C@@]12C[C@@H](C(=O)Nc3nc(Br)ccc3CC(=O)OC)N(C(=O)OC(C)(C)C)[C@@H]1C2.C=C[C@@]12C[C@@H](C(=O)O)N(C(=O)OC(C)(C)C)[C@@H]1C2.CCO.COC(=O)Cc1ccc(Br)nc1N.[Li+].[OH-]
InChIInChI=1S/C27H37BrN4O4.C21H26BrN3O5.C20H24BrN3O5.C13H19NO4.C8H9BrN2O2.C7H15N.C2H6O.7CH4.Li.H2O/c1-7-9-10-11-14-31(6)22(33)15-18-12-13-21(28)29-23(18)30-24(34)19-16-27(8-2)17-20(27)32(19)25(35)36-26(3,4)5;1-6-21-10-13(25(14(21)11-21)19(28)30-20(2,3)4)18(27)24-17-12(9-16(26)29-5)7-8-15(22)23-17;1-5-20-9-12(24(13(20)10-20)18(28)29-19(2,3)4)17(27)23-16-11(8-15(25)26)6-7-14(21)22-16;1-5-13-6-8(10(15)16)14(9(13)7-13)11(17)18-12(2,3)4;1-13-7(12)4-5-2-3-6(9)11-8(5)10;1-3-4-5-6-7-8-2;1-2-3;;;;;;;;;/h7-8,12-13,19-20H,1-2,9-11,14-17H2,3-6H3,(H,29,30,34);6-8,13-14H,1,9-11H2,2-5H3,(H,23,24,27);5-7,12-13H,1,8-10H2,2-4H3,(H,25,26)(H,22,23,27);5,8-9H,1,6-7H2,2-4H3,(H,15,16);2-3H,4H2,1H3,(H2,10,11);3,8H,1,4-7H2,2H3;3H,2H2,1H3;7*1H4;;1H2/q;;;;;;;;;;;;;;+1;/p-1/t19-,20+,27-;13-,14+,21-;12-,13+,20-;8-,9+,13-;;;;;;;;;;;;/m0000............/s1
InChIKeyHJUXNBYWNSJTRG-ZWWVXMIQSA-M
MW2302.11 g/mol
LogP17.92
Rot. Bonds29

About lithium;2-[6-bromo-2-[[(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carbonyl]amino]-3-pyridinyl]acetic acid;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-[2-[hex-5-enyl(methyl)amino]-2-oxoethyl]-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-(2-methoxy-2-oxoethyl)-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;ethanol;(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carboxylic acid;methane;methyl 2-(2-amino-6-bromo-3-pyridinyl)acetate;N-methylhex-5-en-1-amine;hydroxide

lithium;2-[6-bromo-2-[[(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carbonyl]amino]-3-pyridinyl]acetic acid;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-[2-[hex-5-enyl(methyl)amino]-2-oxoethyl]-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-(2-methoxy-2-oxoethyl)-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;ethanol;(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carboxylic acid;methane;methyl 2-(2-amino-6-bromo-3-pyridinyl)acetate;N-methylhex-5-en-1-amine;hydroxide (PubChem CID 158500404) has the molecular formula C105H165Br4LiN14O22 and a molecular weight of 2302.11 g/mol. Its IUPAC name is lithium;2-[6-bromo-2-[[(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carbonyl]amino]-3-pyridinyl]acetic acid;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-[2-[hex-5-enyl(methyl)amino]-2-oxoethyl]-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-(2-methoxy-2-oxoethyl)-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;ethanol;(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carboxylic acid;methane;methyl 2-(2-amino-6-bromo-3-pyridinyl)acetate;N-methylhex-5-en-1-amine;hydroxide.

Molecular Properties

Compound Namelithium;2-[6-bromo-2-[[(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carbonyl]amino]-3-pyridinyl]acetic acid;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-[2-[hex-5-enyl(methyl)amino]-2-oxoethyl]-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-(2-methoxy-2-oxoethyl)-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;ethanol;(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carboxylic acid;methane;methyl 2-(2-amino-6-bromo-3-pyridinyl)acetate;N-methylhex-5-en-1-amine;hydroxide
PubChem CID158500404
Molecular FormulaC105H165Br4LiN14O22
Molecular Weight2302.11 g/mol
Exact Mass2296.91
IUPAC Namelithium;2-[6-bromo-2-[[(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carbonyl]amino]-3-pyridinyl]acetic acid;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-[2-[hex-5-enyl(methyl)amino]-2-oxoethyl]-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-(2-methoxy-2-oxoethyl)-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;ethanol;(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carboxylic acid;methane;methyl 2-(2-amino-6-bromo-3-pyridinyl)acetate;N-methylhex-5-en-1-amine;hydroxide
SMILESC.C.C.C.C.C.C.C=CCCCCN(C)C(=O)Cc1ccc(Br)nc1NC(=O)[C@@H]1C[C@@]2(C=C)C[C@H]2N1C(=O)OC(C)(C)C.C=CCCCCNC.C=C[C@@]12C[C@@H](C(=O)Nc3nc(Br)ccc3CC(=O)O)N(C(=O)OC(C)(C)C)[C@@H]1C2.C=C[C@@]12C[C@@H](C(=O)Nc3nc(Br)ccc3CC(=O)OC)N(C(=O)OC(C)(C)C)[C@@H]1C2.C=C[C@@]12C[C@@H](C(=O)O)N(C(=O)OC(C)(C)C)[C@@H]1C2.CCO.COC(=O)Cc1ccc(Br)nc1N.[Li+].[OH-]
InChIInChI=1S/C27H37BrN4O4.C21H26BrN3O5.C20H24BrN3O5.C13H19NO4.C8H9BrN2O2.C7H15N.C2H6O.7CH4.Li.H2O/c1-7-9-10-11-14-31(6)22(33)15-18-12-13-21(28)29-23(18)30-24(34)19-16-27(8-2)17-20(27)32(19)25(35)36-26(3,4)5;1-6-21-10-13(25(14(21)11-21)19(28)30-20(2,3)4)18(27)24-17-12(9-16(26)29-5)7-8-15(22)23-17;1-5-20-9-12(24(13(20)10-20)18(28)29-19(2,3)4)17(27)23-16-11(8-15(25)26)6-7-14(21)22-16;1-5-13-6-8(10(15)16)14(9(13)7-13)11(17)18-12(2,3)4;1-13-7(12)4-5-2-3-6(9)11-8(5)10;1-3-4-5-6-7-8-2;1-2-3;;;;;;;;;/h7-8,12-13,19-20H,1-2,9-11,14-17H2,3-6H3,(H,29,30,34);6-8,13-14H,1,9-11H2,2-5H3,(H,23,24,27);5-7,12-13H,1,8-10H2,2-4H3,(H,25,26)(H,22,23,27);5,8-9H,1,6-7H2,2-4H3,(H,15,16);2-3H,4H2,1H3,(H2,10,11);3,8H,1,4-7H2,2H3;3H,2H2,1H3;7*1H4;;1H2/q;;;;;;;;;;;;;;+1;/p-1/t19-,20+,27-;13-,14+,21-;12-,13+,20-;8-,9+,13-;;;;;;;;;;;;/m0000............/s1
InChIKeyHJUXNBYWNSJTRG-ZWWVXMIQSA-M
XLogP17.92
TPSA492.81 Ų
H-Bond Donors8
H-Bond Acceptors26
Rotatable Bonds29
Heavy Atoms146
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002302.11
LogP ≤ 517.92
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze lithium;2-[6-bromo-2-[[(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carbonyl]amino]-3-pyridinyl]acetic acid;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-[2-[hex-5-enyl(methyl)amino]-2-oxoethyl]-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-(2-methoxy-2-oxoethyl)-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;ethanol;(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carboxylic acid;methane;methyl 2-(2-amino-6-bromo-3-pyridinyl)acetate;N-methylhex-5-en-1-amine;hydroxide 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 lithium;2-[6-bromo-2-[[(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carbonyl]amino]-3-pyridinyl]acetic acid;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-[2-[hex-5-enyl(methyl)amino]-2-oxoethyl]-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-(2-methoxy-2-oxoethyl)-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;ethanol;(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carboxylic acid;methane;methyl 2-(2-amino-6-bromo-3-pyridinyl)acetate;N-methylhex-5-en-1-amine;hydroxide?
The IUPAC name of lithium;2-[6-bromo-2-[[(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carbonyl]amino]-3-pyridinyl]acetic acid;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-[2-[hex-5-enyl(methyl)amino]-2-oxoethyl]-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-(2-methoxy-2-oxoethyl)-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;ethanol;(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carboxylic acid;methane;methyl 2-(2-amino-6-bromo-3-pyridinyl)acetate;N-methylhex-5-en-1-amine;hydroxide (CID 158500404) is lithium;2-[6-bromo-2-[[(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carbonyl]amino]-3-pyridinyl]acetic acid;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-[2-[hex-5-enyl(methyl)amino]-2-oxoethyl]-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-(2-methoxy-2-oxoethyl)-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;ethanol;(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carboxylic acid;methane;methyl 2-(2-amino-6-bromo-3-pyridinyl)acetate;N-methylhex-5-en-1-amine;hydroxide.
What is the SMILES notation for lithium;2-[6-bromo-2-[[(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carbonyl]amino]-3-pyridinyl]acetic acid;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-[2-[hex-5-enyl(methyl)amino]-2-oxoethyl]-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-(2-methoxy-2-oxoethyl)-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;ethanol;(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carboxylic acid;methane;methyl 2-(2-amino-6-bromo-3-pyridinyl)acetate;N-methylhex-5-en-1-amine;hydroxide?
The canonical SMILES for lithium;2-[6-bromo-2-[[(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carbonyl]amino]-3-pyridinyl]acetic acid;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-[2-[hex-5-enyl(methyl)amino]-2-oxoethyl]-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-(2-methoxy-2-oxoethyl)-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;ethanol;(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carboxylic acid;methane;methyl 2-(2-amino-6-bromo-3-pyridinyl)acetate;N-methylhex-5-en-1-amine;hydroxide is C.C.C.C.C.C.C.C=CCCCCN(C)C(=O)Cc1ccc(Br)nc1NC(=O)[C@@H]1C[C@@]2(C=C)C[C@H]2N1C(=O)OC(C)(C)C.C=CCCCCNC.C=C[C@@]12C[C@@H](C(=O)Nc3nc(Br)ccc3CC(=O)O)N(C(=O)OC(C)(C)C)[C@@H]1C2.C=C[C@@]12C[C@@H](C(=O)Nc3nc(Br)ccc3CC(=O)OC)N(C(=O)OC(C)(C)C)[C@@H]1C2.C=C[C@@]12C[C@@H](C(=O)O)N(C(=O)OC(C)(C)C)[C@@H]1C2.CCO.COC(=O)Cc1ccc(Br)nc1N.[Li+].[OH-].
What is the InChIKey of lithium;2-[6-bromo-2-[[(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carbonyl]amino]-3-pyridinyl]acetic acid;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-[2-[hex-5-enyl(methyl)amino]-2-oxoethyl]-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-(2-methoxy-2-oxoethyl)-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;ethanol;(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carboxylic acid;methane;methyl 2-(2-amino-6-bromo-3-pyridinyl)acetate;N-methylhex-5-en-1-amine;hydroxide?
The InChIKey is HJUXNBYWNSJTRG-ZWWVXMIQSA-M. The full InChI is InChI=1S/C27H37BrN4O4.C21H26BrN3O5.C20H24BrN3O5.C13H19NO4.C8H9BrN2O2.C7H15N.C2H6O.7CH4.Li.H2O/c1-7-9-10-11-14-31(6)22(33)15-18-12-13-21(28)29-23(18)30-24(34)19-16-27(8-2)17-20(27)32(19)25(35)36-26(3,4)5;1-6-21-10-13(25(14(21)11-21)19(28)30-20(2,3)4)18(27)24-17-12(9-16(26)29-5)7-8-15(22)23-17;1-5-20-9-12(24(13(20)10-20)18(28)29-19(2,3)4)17(27)23-16-11(8-15(25)26)6-7-14(21)22-16;1-5-13-6-8(10(15)16)14(9(13)7-13)11(17)18-12(2,3)4;1-13-7(12)4-5-2-3-6(9)11-8(5)10;1-3-4-5-6-7-8-2;1-2-3;;;;;;;;;/h7-8,12-13,19-20H,1-2,9-11,14-17H2,3-6H3,(H,29,30,34);6-8,13-14H,1,9-11H2,2-5H3,(H,23,24,27);5-7,12-13H,1,8-10H2,2-4H3,(H,25,26)(H,22,23,27);5,8-9H,1,6-7H2,2-4H3,(H,15,16);2-3H,4H2,1H3,(H2,10,11);3,8H,1,4-7H2,2H3;3H,2H2,1H3;7*1H4;;1H2/q;;;;;;;;;;;;;;+1;/p-1/t19-,20+,27-;13-,14+,21-;12-,13+,20-;8-,9+,13-;;;;;;;;;;;;/m0000............/s1.
What are the key properties of lithium;2-[6-bromo-2-[[(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carbonyl]amino]-3-pyridinyl]acetic acid;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-[2-[hex-5-enyl(methyl)amino]-2-oxoethyl]-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-(2-methoxy-2-oxoethyl)-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;ethanol;(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carboxylic acid;methane;methyl 2-(2-amino-6-bromo-3-pyridinyl)acetate;N-methylhex-5-en-1-amine;hydroxide?
lithium;2-[6-bromo-2-[[(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carbonyl]amino]-3-pyridinyl]acetic acid;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-[2-[hex-5-enyl(methyl)amino]-2-oxoethyl]-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-(2-methoxy-2-oxoethyl)-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;ethanol;(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carboxylic acid;methane;methyl 2-(2-amino-6-bromo-3-pyridinyl)acetate;N-methylhex-5-en-1-amine;hydroxide has a molecular weight of 2302.11 g/mol, XLogP of 17.92, 29 rotatable bonds, 8 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;2-[6-bromo-2-[[(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carbonyl]amino]-3-pyridinyl]acetic acid;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-[2-[hex-5-enyl(methyl)amino]-2-oxoethyl]-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;tert-butyl (1R,3S,5R)-3-[[6-bromo-3-(2-methoxy-2-oxoethyl)-2-pyridinyl]carbamoyl]-5-ethenyl-2-azabicyclo[3.1.0]hexane-2-carboxylate;ethanol;(1R,3S,5R)-5-ethenyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azabicyclo[3.1.0]hexane-3-carboxylic acid;methane;methyl 2-(2-amino-6-bromo-3-pyridinyl)acetate;N-methylhex-5-en-1-amine;hydroxide is sourced from PubChem (CID 158500404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).