(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pentanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-6-ylamino)-4-[4-(trifluoromethyl)phenyl]butan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]pentanediamide

C138H172F9N35O15 — CID 161434590

IUPAC(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pentanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-6-ylamino)-4-[4-(trifluoromethyl)phenyl]butan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]pentanediamide
SMILESNCCN(CCN)C(=O)CC[C@@H](N)C(=O)N[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cnc2ccccc2c1.NCCN(CCN)C(=O)CC[C@H](N)C(=O)N[C@H](CCc1ccccc1)C(=O)Nc1cnc2ccccc2c1.NCCN(CCN)C(=O)C[C@@H](N)C(=O)N[C@H](CCc1ccccc1)C(=O)Nc1cnc2ccccc2c1.NCCN(CCN)C(=O)C[C@@H](N)C(=O)N[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cnc2ccccc2c1.NCCN(CCN)C(=O)C[C@H](N)C(=O)N[C@H](CCc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc2ncccc2c1
InChIInChI=1S/2C28H34F3N7O3.C28H37N7O3.C27H32F3N7O3.C27H35N7O3/c29-28(30,31)20-6-3-18(4-7-20)5-9-24(27(41)36-21-8-10-23-19(16-21)2-1-13-35-23)37-26(40)22(34)17-25(39)38(14-11-32)15-12-33;29-28(30,31)20-7-5-18(6-8-20)15-24(27(41)36-21-16-19-3-1-2-4-23(19)35-17-21)37-26(40)22(34)9-10-25(39)38(13-11-32)14-12-33;29-14-16-35(17-15-30)26(36)13-11-23(31)27(37)34-25(12-10-20-6-2-1-3-7-20)28(38)33-22-18-21-8-4-5-9-24(21)32-19-22;28-27(29,30)19-7-5-17(6-8-19)13-23(26(40)35-20-14-18-3-1-2-4-22(18)34-16-20)36-25(39)21(33)15-24(38)37(11-9-31)12-10-32;28-12-14-34(15-13-29)25(35)17-22(30)26(36)33-24(11-10-19-6-2-1-3-7-19)27(37)32-21-16-20-8-4-5-9-23(20)31-18-21/h1-4,6-8,10,13,16,22,24H,5,9,11-12,14-15,17,32-34H2,(H,36,41)(H,37,40);1-8,16-17,22,24H,9-15,32-34H2,(H,36,41)(H,37,40);1-9,18-19,23,25H,10-17,29-31H2,(H,33,38)(H,34,37);1-8,14,16,21,23H,9-13,15,31-33H2,(H,35,40)(H,36,39);1-9,16,18,22,24H,10-15,17,28-30H2,(H,32,37)(H,33,36)/t22-,24+;22-,24-;23-,25+;21-,23-;22-,24-/m01011/s1
InChIKeyVYLZLBNMBWUSIB-AMXIJTSESA-N
MW2732.11 g/mol
LogP6.83
Rot. Bonds65

About (2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pentanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-6-ylamino)-4-[4-(trifluoromethyl)phenyl]butan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]pentanediamide

(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pentanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-6-ylamino)-4-[4-(trifluoromethyl)phenyl]butan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]pentanediamide (PubChem CID 161434590) has the molecular formula C138H172F9N35O15 and a molecular weight of 2732.11 g/mol. Its IUPAC name is (2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pentanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-6-ylamino)-4-[4-(trifluoromethyl)phenyl]butan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]pentanediamide.

Molecular Properties

Compound Name(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pentanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-6-ylamino)-4-[4-(trifluoromethyl)phenyl]butan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]pentanediamide
PubChem CID161434590
Molecular FormulaC138H172F9N35O15
Molecular Weight2732.11 g/mol
Exact Mass2730.36
IUPAC Name(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pentanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-6-ylamino)-4-[4-(trifluoromethyl)phenyl]butan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]pentanediamide
SMILESNCCN(CCN)C(=O)CC[C@@H](N)C(=O)N[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cnc2ccccc2c1.NCCN(CCN)C(=O)CC[C@H](N)C(=O)N[C@H](CCc1ccccc1)C(=O)Nc1cnc2ccccc2c1.NCCN(CCN)C(=O)C[C@@H](N)C(=O)N[C@H](CCc1ccccc1)C(=O)Nc1cnc2ccccc2c1.NCCN(CCN)C(=O)C[C@@H](N)C(=O)N[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cnc2ccccc2c1.NCCN(CCN)C(=O)C[C@H](N)C(=O)N[C@H](CCc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc2ncccc2c1
InChIInChI=1S/2C28H34F3N7O3.C28H37N7O3.C27H32F3N7O3.C27H35N7O3/c29-28(30,31)20-6-3-18(4-7-20)5-9-24(27(41)36-21-8-10-23-19(16-21)2-1-13-35-23)37-26(40)22(34)17-25(39)38(14-11-32)15-12-33;29-28(30,31)20-7-5-18(6-8-20)15-24(27(41)36-21-16-19-3-1-2-4-23(19)35-17-21)37-26(40)22(34)9-10-25(39)38(13-11-32)14-12-33;29-14-16-35(17-15-30)26(36)13-11-23(31)27(37)34-25(12-10-20-6-2-1-3-7-20)28(38)33-22-18-21-8-4-5-9-24(21)32-19-22;28-27(29,30)19-7-5-17(6-8-19)13-23(26(40)35-20-14-18-3-1-2-4-22(18)34-16-20)36-25(39)21(33)15-24(38)37(11-9-31)12-10-32;28-12-14-34(15-13-29)25(35)17-22(30)26(36)33-24(11-10-19-6-2-1-3-7-19)27(37)32-21-16-20-8-4-5-9-23(20)31-18-21/h1-4,6-8,10,13,16,22,24H,5,9,11-12,14-15,17,32-34H2,(H,36,41)(H,37,40);1-8,16-17,22,24H,9-15,32-34H2,(H,36,41)(H,37,40);1-9,18-19,23,25H,10-17,29-31H2,(H,33,38)(H,34,37);1-8,14,16,21,23H,9-13,15,31-33H2,(H,35,40)(H,36,39);1-9,16,18,22,24H,10-15,17,28-30H2,(H,32,37)(H,33,36)/t22-,24+;22-,24-;23-,25+;21-,23-;22-,24-/m01011/s1
InChIKeyVYLZLBNMBWUSIB-AMXIJTSESA-N
XLogP6.83
TPSA847.30 Ų
H-Bond Donors25
H-Bond Acceptors35
Rotatable Bonds65
Heavy Atoms197
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002732.11
LogP ≤ 56.83
H-Bond Donors ≤ 525
H-Bond Acceptors ≤ 1035

Analyze (2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pentanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-6-ylamino)-4-[4-(trifluoromethyl)phenyl]butan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]pentanediamide 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 (2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pentanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-6-ylamino)-4-[4-(trifluoromethyl)phenyl]butan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]pentanediamide?
The IUPAC name of (2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pentanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-6-ylamino)-4-[4-(trifluoromethyl)phenyl]butan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]pentanediamide (CID 161434590) is (2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pentanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-6-ylamino)-4-[4-(trifluoromethyl)phenyl]butan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]pentanediamide.
What is the SMILES notation for (2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pentanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-6-ylamino)-4-[4-(trifluoromethyl)phenyl]butan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]pentanediamide?
The canonical SMILES for (2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pentanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-6-ylamino)-4-[4-(trifluoromethyl)phenyl]butan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]pentanediamide is NCCN(CCN)C(=O)CC[C@@H](N)C(=O)N[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cnc2ccccc2c1.NCCN(CCN)C(=O)CC[C@H](N)C(=O)N[C@H](CCc1ccccc1)C(=O)Nc1cnc2ccccc2c1.NCCN(CCN)C(=O)C[C@@H](N)C(=O)N[C@H](CCc1ccccc1)C(=O)Nc1cnc2ccccc2c1.NCCN(CCN)C(=O)C[C@@H](N)C(=O)N[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cnc2ccccc2c1.NCCN(CCN)C(=O)C[C@H](N)C(=O)N[C@H](CCc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc2ncccc2c1.
What is the InChIKey of (2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pentanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-6-ylamino)-4-[4-(trifluoromethyl)phenyl]butan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]pentanediamide?
The InChIKey is VYLZLBNMBWUSIB-AMXIJTSESA-N. The full InChI is InChI=1S/2C28H34F3N7O3.C28H37N7O3.C27H32F3N7O3.C27H35N7O3/c29-28(30,31)20-6-3-18(4-7-20)5-9-24(27(41)36-21-8-10-23-19(16-21)2-1-13-35-23)37-26(40)22(34)17-25(39)38(14-11-32)15-12-33;29-28(30,31)20-7-5-18(6-8-20)15-24(27(41)36-21-16-19-3-1-2-4-23(19)35-17-21)37-26(40)22(34)9-10-25(39)38(13-11-32)14-12-33;29-14-16-35(17-15-30)26(36)13-11-23(31)27(37)34-25(12-10-20-6-2-1-3-7-20)28(38)33-22-18-21-8-4-5-9-24(21)32-19-22;28-27(29,30)19-7-5-17(6-8-19)13-23(26(40)35-20-14-18-3-1-2-4-22(18)34-16-20)36-25(39)21(33)15-24(38)37(11-9-31)12-10-32;28-12-14-34(15-13-29)25(35)17-22(30)26(36)33-24(11-10-19-6-2-1-3-7-19)27(37)32-21-16-20-8-4-5-9-23(20)31-18-21/h1-4,6-8,10,13,16,22,24H,5,9,11-12,14-15,17,32-34H2,(H,36,41)(H,37,40);1-8,16-17,22,24H,9-15,32-34H2,(H,36,41)(H,37,40);1-9,18-19,23,25H,10-17,29-31H2,(H,33,38)(H,34,37);1-8,14,16,21,23H,9-13,15,31-33H2,(H,35,40)(H,36,39);1-9,16,18,22,24H,10-15,17,28-30H2,(H,32,37)(H,33,36)/t22-,24+;22-,24-;23-,25+;21-,23-;22-,24-/m01011/s1.
What are the key properties of (2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pentanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-6-ylamino)-4-[4-(trifluoromethyl)phenyl]butan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]pentanediamide?
(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pentanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-6-ylamino)-4-[4-(trifluoromethyl)phenyl]butan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]pentanediamide has a molecular weight of 2732.11 g/mol, XLogP of 6.83, 65 rotatable bonds, 25 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]butanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pentanediamide;(2S)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-6-ylamino)-4-[4-(trifluoromethyl)phenyl]butan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]butanediamide;(2R)-2-amino-N',N'-bis(2-aminoethyl)-N-[(2R)-1-oxo-1-(quinolin-3-ylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-yl]pentanediamide is sourced from PubChem (CID 161434590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).