2-(aminomethylcarbamoyl)-4-[2-[3-[[5-[2-[2-(aminomethyl)-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]methylcarbamoyl]-4-carboxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid;O-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]hydroxylamine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;prop-1-ene

C71H58F18N8O19 — CID 159396934

IUPAC2-(aminomethylcarbamoyl)-4-[2-[3-[[5-[2-[2-(aminomethyl)-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]methylcarbamoyl]-4-carboxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid;O-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]hydroxylamine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;prop-1-ene
SMILESC=CC.CC(N)COCCOCC(C)ON.NCNC(=O)c1cc(C(c2ccc(C(=O)O)c(C(=O)NCN3C(=O)c4ccc(C(c5ccc6c(c5)C(=O)N(CN)C6=O)(C(F)(F)F)C(F)(F)F)cc4C3=O)c2)(C(F)(F)F)C(F)(F)F)ccc1C(=O)O.O=C1OC(=O)c2cc(C(c3ccc4c(c3)C(=O)OC4=O)(C(F)(F)F)C(F)(F)F)ccc21
InChIInChI=1S/C41H26F12N6O10.C19H6F6O6.C8H20N2O3.C3H6/c42-38(43,44)36(39(45,46)47,16-3-7-22(34(66)67)24(9-16)28(60)56-13-54)17-4-8-23(35(68)69)25(10-17)29(61)57-15-59-31(63)21-6-2-19(12-27(21)33(59)65)37(40(48,49)50,41(51,52)53)18-1-5-20-26(11-18)32(64)58(14-55)30(20)62;20-18(21,22)17(19(23,24)25,7-1-3-9-11(5-7)15(28)30-13(9)26)8-2-4-10-12(6-8)16(29)31-14(10)27;1-7(9)5-11-3-4-12-6-8(2)13-10;1-3-2/h1-12H,13-15,54-55H2,(H,56,60)(H,57,61)(H,66,67)(H,68,69);1-6H;7-8H,3-6,9-10H2,1-2H3;3H,1H2,2H3
InChIKeyLMVPASDABISOBW-UHFFFAOYSA-N
MW1669.25 g/mol
LogP9.60
Rot. Bonds22

About 2-(aminomethylcarbamoyl)-4-[2-[3-[[5-[2-[2-(aminomethyl)-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]methylcarbamoyl]-4-carboxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid;O-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]hydroxylamine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;prop-1-ene

2-(aminomethylcarbamoyl)-4-[2-[3-[[5-[2-[2-(aminomethyl)-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]methylcarbamoyl]-4-carboxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid;O-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]hydroxylamine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;prop-1-ene (PubChem CID 159396934) has the molecular formula C71H58F18N8O19 and a molecular weight of 1669.25 g/mol. Its IUPAC name is 2-(aminomethylcarbamoyl)-4-[2-[3-[[5-[2-[2-(aminomethyl)-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]methylcarbamoyl]-4-carboxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid;O-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]hydroxylamine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;prop-1-ene.

Molecular Properties

Compound Name2-(aminomethylcarbamoyl)-4-[2-[3-[[5-[2-[2-(aminomethyl)-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]methylcarbamoyl]-4-carboxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid;O-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]hydroxylamine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;prop-1-ene
PubChem CID159396934
Molecular FormulaC71H58F18N8O19
Molecular Weight1669.25 g/mol
Exact Mass1668.35
IUPAC Name2-(aminomethylcarbamoyl)-4-[2-[3-[[5-[2-[2-(aminomethyl)-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]methylcarbamoyl]-4-carboxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid;O-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]hydroxylamine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;prop-1-ene
SMILESC=CC.CC(N)COCCOCC(C)ON.NCNC(=O)c1cc(C(c2ccc(C(=O)O)c(C(=O)NCN3C(=O)c4ccc(C(c5ccc6c(c5)C(=O)N(CN)C6=O)(C(F)(F)F)C(F)(F)F)cc4C3=O)c2)(C(F)(F)F)C(F)(F)F)ccc1C(=O)O.O=C1OC(=O)c2cc(C(c3ccc4c(c3)C(=O)OC4=O)(C(F)(F)F)C(F)(F)F)ccc21
InChIInChI=1S/C41H26F12N6O10.C19H6F6O6.C8H20N2O3.C3H6/c42-38(43,44)36(39(45,46)47,16-3-7-22(34(66)67)24(9-16)28(60)56-13-54)17-4-8-23(35(68)69)25(10-17)29(61)57-15-59-31(63)21-6-2-19(12-27(21)33(59)65)37(40(48,49)50,41(51,52)53)18-1-5-20-26(11-18)32(64)58(14-55)30(20)62;20-18(21,22)17(19(23,24)25,7-1-3-9-11(5-7)15(28)30-13(9)26)8-2-4-10-12(6-8)16(29)31-14(10)27;1-7(9)5-11-3-4-12-6-8(2)13-10;1-3-2/h1-12H,13-15,54-55H2,(H,56,60)(H,57,61)(H,66,67)(H,68,69);1-6H;7-8H,3-6,9-10H2,1-2H3;3H,1H2,2H3
InChIKeyLMVPASDABISOBW-UHFFFAOYSA-N
XLogP9.60
TPSA426.07 Ų
H-Bond Donors8
H-Bond Acceptors21
Rotatable Bonds22
Heavy Atoms116
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001669.25
LogP ≤ 59.60
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-(aminomethylcarbamoyl)-4-[2-[3-[[5-[2-[2-(aminomethyl)-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]methylcarbamoyl]-4-carboxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid;O-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]hydroxylamine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;prop-1-ene with MolForge

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Related Compounds

5-[2-(2-Butyl-1,3-dioxoisoindol-5-yl)-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1-trifluoropropan-2-yl]-2-benzofuran-1,3-dione;methanediamine
CID 157553934
2,4-Bis[2-(2-methylprop-2-enoyloxy)ethoxycarbonyl]benzoic acid;4-[2-[3-carboxy-4-[2-(2-methylprop-2-enoyloxy)ethoxycarbonyl]phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-[2-(2-methylprop-2-enoyloxy)ethoxycarbonyl]benzoic acid;4-[2-[4-carboxy-3-[2-(2-methylprop-2-enoyloxy)ethoxycarbonyl]phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-[2-(2-methylprop-2-enoyloxy)ethoxycarbonyl]benzoic acid;5-[2-[3-carboxy-4-[2-(2-methylprop-2-enoyloxy)ethoxycarbonyl]phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-[2-(2-methylprop-2-enoyloxy)ethoxycarbonyl]benzoic acid;2-[5-[1,1,1,3,3,3-hexafluoro-2-[2-[2-(2-methylprop-2-enoyloxy)ethyl]-1,3-dioxoisoindol-5-yl]propan-2-yl]-1,3-dioxoinden-2-yl]ethyl 2-methylprop-2-enoate;2-[[2-[2-(2-methylprop-2-enoyloxy)ethyl]-1,3-dioxoisoindole-5-carbonyl]amino]ethyl 2-methylprop-2-enoate;tris[2-(2-methylprop-2-enoyloxy)ethyl] benzene-1,2,4-tricarboxylate
CID 157657834
[(3aS,10aS)-2,6-diamino-10,10-dihydroxy-4-[(3-methyl-2,5-dioxoimidazolidin-1-yl)methyl]-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-9-yl] 2,5-bis(trifluoromethyl)benzoate;1-[[(3aS,9S,10aS)-2,6-diamino-10,10-dihydroxy-9-oxidoperoxy-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-4-yl]methyl]pyrrolidine-2,5-dione;[(3aS,10aS)-2,6-diamino-4-[(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)methyl]-10,10-dihydroxy-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-9-yl] benzoate;[(3aS,10aS)-2,6-diamino-4-[(2,5-dioxoimidazolidin-1-yl)methyl]-10,10-dihydroxy-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-9-yl] 2,5-bis(trifluoromethyl)benzoate;N-[(3aS,10aS)-2,6-diamino-4-[(2,5-dioxopyrrolidin-1-yl)methyl]-10,10-dihydroxy-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-9-yl]-2,5-bis(trifluoromethyl)benzamide;sulfur monoxide
CID 157693941
4-[(4-Aminocyclohexyl)methyl]cyclohexan-1-amine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;5-[1,1,1,3,3,3-hexafluoro-2-[2-[4-[(4-methylcyclohexyl)methyl]cyclohexyl]-1,3-dioxoisoindol-5-yl]propan-2-yl]-2-methylisoindole-1,3-dione
CID 157915914
5-[2-(2-Butyl-1,3-dioxoisoindol-5-yl)-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1-trifluoropropan-2-yl]-2-benzofuran-1,3-dione;methane;methanediamine
CID 158801435
4-[(4-Aminocyclohexyl)methyl]cyclohexan-1-amine;5-[2-[4-carboxy-3-[[4-[(4-methylcyclohexyl)methyl]cyclohexyl]carbamoyl]phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-(methylcarbamoyl)benzoic acid;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;5-[1,1,1,3,3,3-hexafluoro-2-[2-[4-[(4-methylcyclohexyl)methyl]cyclohexyl]-1,3-dioxoisoindol-5-yl]propan-2-yl]-2-methylisoindole-1,3-dione
CID 159300299
5-[2-(2-Butyl-1,3-dioxoisoindol-5-yl)-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1-trifluoropropan-2-yl]-2-benzofuran-1,3-dione;methane;methanediamine
CID 160321750
5-[2-(2-Butyl-1,3-dioxoisoindol-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-methylisoindole-1,3-dione;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;methanediamine
CID 160385880
[(3aS,10aS)-2,6-diamino-10,10-dihydroxy-4-[(3-oxo-1H-isoindol-2-yl)methyl]-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-9-yl] benzoate;[(3aS,10aS)-2,6-diamino-10,10-dihydroxy-4-[(3-oxo-1H-isoindol-2-yl)methyl]-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-9-yl] 2,5-bis(trifluoromethyl)benzoate;[(3aS,10aS)-2,6-diamino-4-[(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)methyl]-10,10-dihydroxy-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-9-yl] 2-methyl-5-(trifluoromethyl)benzoate;[(3aS,10aS)-2,6-diamino-4-[(1,3-dioxoisoindol-2-yl)methyl]-10,10-dihydroxy-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-9-yl] benzoate;[(3aS,10aS)-2,6-diamino-4-[(1,3-dioxoisoindol-2-yl)methyl]-10,10-dihydroxy-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purin-9-yl] 2,5-bis(trifluoromethyl)benzoate
CID 161021599
Bis(3,5-dimethylbenzoic acid);tris(1,2,3,4,5,6-hexamethylbenzene);3-hydroxypropyl 3,5-dimethylbenzoate;methane;2-(2-methylprop-2-enoyloxy)ethyl 3,5-dimethylbenzoate;tris(2-methyl-5-[1,1,1-trifluoro-2-(2-methyl-1,3-dioxoisoindol-5-yl)propan-2-yl]isoindole-1,3-dione)
CID 161162821
3,5-Dimethylbenzoic acid;2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene;2,6-dimethylpyrrolo[3,4-f]isoindole-1,3,5,7-tetrone;bis(1,2,3,4,5,6-hexamethylbenzene);2-methyl-5-(2-methyl-1,3-dioxoisoindol-5-yl)isoindole-1,3-dione;tris(2-(2-methylprop-2-enoyloxy)ethyl 3,5-dimethylbenzoate)
CID 161535904
4-[(4-Aminocyclohexyl)methyl]cyclohexan-1-amine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;5-[1,1,1,3,3,3-hexafluoro-2-[2-[4-[(4-methylcyclohexyl)methyl]cyclohexyl]-1,3-dioxoisoindol-5-yl]propan-2-yl]-2-methylisoindole-1,3-dione;methane
CID 161686707

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethylcarbamoyl)-4-[2-[3-[[5-[2-[2-(aminomethyl)-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]methylcarbamoyl]-4-carboxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid;O-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]hydroxylamine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;prop-1-ene?
The IUPAC name of 2-(aminomethylcarbamoyl)-4-[2-[3-[[5-[2-[2-(aminomethyl)-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]methylcarbamoyl]-4-carboxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid;O-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]hydroxylamine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;prop-1-ene (CID 159396934) is 2-(aminomethylcarbamoyl)-4-[2-[3-[[5-[2-[2-(aminomethyl)-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]methylcarbamoyl]-4-carboxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid;O-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]hydroxylamine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;prop-1-ene.
What is the SMILES notation for 2-(aminomethylcarbamoyl)-4-[2-[3-[[5-[2-[2-(aminomethyl)-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]methylcarbamoyl]-4-carboxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid;O-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]hydroxylamine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;prop-1-ene?
The canonical SMILES for 2-(aminomethylcarbamoyl)-4-[2-[3-[[5-[2-[2-(aminomethyl)-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]methylcarbamoyl]-4-carboxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid;O-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]hydroxylamine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;prop-1-ene is C=CC.CC(N)COCCOCC(C)ON.NCNC(=O)c1cc(C(c2ccc(C(=O)O)c(C(=O)NCN3C(=O)c4ccc(C(c5ccc6c(c5)C(=O)N(CN)C6=O)(C(F)(F)F)C(F)(F)F)cc4C3=O)c2)(C(F)(F)F)C(F)(F)F)ccc1C(=O)O.O=C1OC(=O)c2cc(C(c3ccc4c(c3)C(=O)OC4=O)(C(F)(F)F)C(F)(F)F)ccc21.
What is the InChIKey of 2-(aminomethylcarbamoyl)-4-[2-[3-[[5-[2-[2-(aminomethyl)-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]methylcarbamoyl]-4-carboxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid;O-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]hydroxylamine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;prop-1-ene?
The InChIKey is LMVPASDABISOBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H26F12N6O10.C19H6F6O6.C8H20N2O3.C3H6/c42-38(43,44)36(39(45,46)47,16-3-7-22(34(66)67)24(9-16)28(60)56-13-54)17-4-8-23(35(68)69)25(10-17)29(61)57-15-59-31(63)21-6-2-19(12-27(21)33(59)65)37(40(48,49)50,41(51,52)53)18-1-5-20-26(11-18)32(64)58(14-55)30(20)62;20-18(21,22)17(19(23,24)25,7-1-3-9-11(5-7)15(28)30-13(9)26)8-2-4-10-12(6-8)16(29)31-14(10)27;1-7(9)5-11-3-4-12-6-8(2)13-10;1-3-2/h1-12H,13-15,54-55H2,(H,56,60)(H,57,61)(H,66,67)(H,68,69);1-6H;7-8H,3-6,9-10H2,1-2H3;3H,1H2,2H3.
What are the key properties of 2-(aminomethylcarbamoyl)-4-[2-[3-[[5-[2-[2-(aminomethyl)-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]methylcarbamoyl]-4-carboxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid;O-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]hydroxylamine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;prop-1-ene?
2-(aminomethylcarbamoyl)-4-[2-[3-[[5-[2-[2-(aminomethyl)-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]methylcarbamoyl]-4-carboxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid;O-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]hydroxylamine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;prop-1-ene has a molecular weight of 1669.25 g/mol, XLogP of 9.60, 22 rotatable bonds, 8 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethylcarbamoyl)-4-[2-[3-[[5-[2-[2-(aminomethyl)-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]methylcarbamoyl]-4-carboxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]benzoic acid;O-[1-[2-(2-aminopropoxy)ethoxy]propan-2-yl]hydroxylamine;5-[2-(1,3-dioxo-2-benzofuran-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-benzofuran-1,3-dione;prop-1-ene is sourced from PubChem (CID 159396934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).