benzyl (2S)-2-amino-5-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-5-oxopentanoate;1-[4-[[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-2,2-dimethylpropan-1-one;[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-(1-methylcyclohexyl)methanone;2-N-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methyl]-2-N-(1H-imidazol-2-ylmethyl)-4-N-piperidin-4-ylpyrimidine-2,4-diamine;ethyl 4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidine-1-carboxylate

C182H303N63O8 — CID 160984325

About benzyl (2S)-2-amino-5-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-5-oxopentanoate;1-[4-[[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-2,2-dimethylpropan-1-one;[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-(1-methylcyclohexyl)methanone;2-N-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methyl]-2-N-(1H-imidazol-2-ylmethyl)-4-N-piperidin-4-ylpyrimidine-2,4-diamine;ethyl 4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidine-1-carboxylate

benzyl (2S)-2-amino-5-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-5-oxopentanoate;1-[4-[[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-2,2-dimethylpropan-1-one;[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-(1-methylcyclohexyl)methanone;2-N-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methyl]-2-N-(1H-imidazol-2-ylmethyl)-4-N-piperidin-4-ylpyrimidine-2,4-diamine;ethyl 4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidine-1-carboxylate (PubChem CID 160984325) has the molecular formula C182H303N63O8 and a molecular weight of 3501.86 g/mol. Its IUPAC name is benzyl (2S)-2-amino-5-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-5-oxopentanoate;1-[4-[[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-2,2-dimethylpropan-1-one;[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-(1-methylcyclohexyl)methanone;2-N-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methyl]-2-N-(1H-imidazol-2-ylmethyl)-4-N-piperidin-4-ylpyrimidine-2,4-diamine;ethyl 4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidine-1-carboxylate.

Molecular Properties

• Compound Name: benzyl (2S)-2-amino-5-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-5-oxopentanoate;1-[4-[[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-2,2-dimethylpropan-1-one;[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-(1-methylcyclohexyl)methanone;2-N-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methyl]-2-N-(1H-imidazol-2-ylmethyl)-4-N-piperidin-4-ylpyrimidine-2,4-diamine;ethyl 4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidine-1-carboxylate
• PubChem CID: 160984325
• Molecular Formula: C182H303N63O8
• Molecular Weight: 3501.86 g/mol
• Exact Mass: 3499.52
• IUPAC Name: benzyl (2S)-2-amino-5-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-5-oxopentanoate;1-[4-[[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-2,2-dimethylpropan-1-one;[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-(1-methylcyclohexyl)methanone;2-N-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methyl]-2-N-(1H-imidazol-2-ylmethyl)-4-N-piperidin-4-ylpyrimidine-2,4-diamine;ethyl 4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidine-1-carboxylate
• SMILES: CC(C)(C)C(=O)N1CCC(CNc2ccnc(NCc3cn(CCCNCCCNC4CCCCC4)nn3)n2)CC1.CC(C)(C)C(=O)N1CCC(Nc2ccnc(NCc3cn(CCCNCCCNC4CCCCC4)nn3)n2)CC1.CC1(C(=O)N2CCC(Nc3ccnc(NCc4cn(CCCNCCCNC5CCCCC5)nn4)n3)CC2)CCCCC1.CCOC(=O)N1CCC(Nc2ccnc(NCc3cn(CCCNCCCNC4CCCCC4)nn3)n2)CC1.N[C@@H](CCC(=O)N1CCC(Nc2ccnc(NCc3cn(CCCNCCCNC4CCCCC4)nn3)n2)CC1)C(=O)OCc1ccccc1.c1cc(NC2CCNCC2)nc(N(Cc2cn(CCCNCCCNC3CCCCC3)nn2)Cc2ncc[nH]2)n1
• InChI: InChI=1S/C36H55N11O3.C32H54N10O.C30H52N10O.C29H50N10O.C28H46N12.C27H46N10O2/c37-32(35(49)50-27-28-9-3-1-4-10-28)13-14-34(48)46-23-16-30(17-24-46)42-33-15-21-40-36(43-33)41-25-31-26-47(45-44-31)22-8-19-38-18-7-20-39-29-11-5-2-6-12-29;1-32(15-6-3-7-16-32)30(43)41-22-13-27(14-23-41)37-29-12-20-35-31(38-29)36-24-28-25-42(40-39-28)21-9-18-33-17-8-19-34-26-10-4-2-5-11-26;1-30(2,3)28(41)39-19-12-24(13-20-39)21-34-27-11-17-33-29(36-27)35-22-26-23-40(38-37-26)18-8-15-31-14-7-16-32-25-9-5-4-6-10-25;1-29(2,3)27(40)38-19-12-24(13-20-38)34-26-11-17-32-28(35-26)33-21-25-22-39(37-36-25)18-8-15-30-14-7-16-31-23-9-5-4-6-10-23;1-2-6-23(7-3-1)31-13-4-11-29-12-5-19-40-21-25(37-38-40)20-39(22-27-32-17-18-33-27)28-34-16-10-26(36-28)35-24-8-14-30-15-9-24;1-2-39-27(38)36-18-11-23(12-19-36)32-25-10-16-30-26(33-25)31-20-24-21-37(35-34-24)17-7-14-28-13-6-15-29-22-8-4-3-5-9-22/h1,3-4,9-10,15,21,26,29-30,32,38-39H,2,5-8,11-14,16-20,22-25,27,37H2,(H2,40,41,42,43);12,20,25-27,33-34H,2-11,13-19,21-24H2,1H3,(H2,35,36,37,38);11,17,23-25,31-32H,4-10,12-16,18-22H2,1-3H3,(H2,33,34,35,36);11,17,22-24,30-31H,4-10,12-16,18-21H2,1-3H3,(H2,32,33,34,35);10,16-18,21,23-24,29-31H,1-9,11-15,19-20,22H2,(H,32,33)(H,34,35,36);10,16,21-23,28-29H,2-9,11-15,17-20H2,1H3,(H2,30,31,32,33)/t32-;;;;;/m0...../s1
• InChIKey: SZXQRMMJWGWEJQ-OUMQCAPYSA-N
• XLogP: 20.12
• TPSA: 822.68 Ų
• H-Bond Donors: 26
• H-Bond Acceptors: 65
• Rotatable Bonds: 95
• Heavy Atoms: 253
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3501.86
LogP ≤ 5	20.12
H-Bond Donors ≤ 5	26
H-Bond Acceptors ≤ 10	65

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of benzyl (2S)-2-amino-5-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-5-oxopentanoate;1-[4-[[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-2,2-dimethylpropan-1-one;[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-(1-methylcyclohexyl)methanone;2-N-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methyl]-2-N-(1H-imidazol-2-ylmethyl)-4-N-piperidin-4-ylpyrimidine-2,4-diamine;ethyl 4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidine-1-carboxylate?

The IUPAC name of benzyl (2S)-2-amino-5-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-5-oxopentanoate;1-[4-[[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-2,2-dimethylpropan-1-one;[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-(1-methylcyclohexyl)methanone;2-N-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methyl]-2-N-(1H-imidazol-2-ylmethyl)-4-N-piperidin-4-ylpyrimidine-2,4-diamine;ethyl 4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidine-1-carboxylate (CID 160984325) is benzyl (2S)-2-amino-5-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-5-oxopentanoate;1-[4-[[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-2,2-dimethylpropan-1-one;[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-(1-methylcyclohexyl)methanone;2-N-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methyl]-2-N-(1H-imidazol-2-ylmethyl)-4-N-piperidin-4-ylpyrimidine-2,4-diamine;ethyl 4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidine-1-carboxylate.

What is the SMILES notation for benzyl (2S)-2-amino-5-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-5-oxopentanoate;1-[4-[[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-2,2-dimethylpropan-1-one;[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-(1-methylcyclohexyl)methanone;2-N-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methyl]-2-N-(1H-imidazol-2-ylmethyl)-4-N-piperidin-4-ylpyrimidine-2,4-diamine;ethyl 4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidine-1-carboxylate?

The canonical SMILES for benzyl (2S)-2-amino-5-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-5-oxopentanoate;1-[4-[[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-2,2-dimethylpropan-1-one;[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-(1-methylcyclohexyl)methanone;2-N-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methyl]-2-N-(1H-imidazol-2-ylmethyl)-4-N-piperidin-4-ylpyrimidine-2,4-diamine;ethyl 4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidine-1-carboxylate is CC(C)(C)C(=O)N1CCC(CNc2ccnc(NCc3cn(CCCNCCCNC4CCCCC4)nn3)n2)CC1.CC(C)(C)C(=O)N1CCC(Nc2ccnc(NCc3cn(CCCNCCCNC4CCCCC4)nn3)n2)CC1.CC1(C(=O)N2CCC(Nc3ccnc(NCc4cn(CCCNCCCNC5CCCCC5)nn4)n3)CC2)CCCCC1.CCOC(=O)N1CCC(Nc2ccnc(NCc3cn(CCCNCCCNC4CCCCC4)nn3)n2)CC1.N[C@@H](CCC(=O)N1CCC(Nc2ccnc(NCc3cn(CCCNCCCNC4CCCCC4)nn3)n2)CC1)C(=O)OCc1ccccc1.c1cc(NC2CCNCC2)nc(N(Cc2cn(CCCNCCCNC3CCCCC3)nn2)Cc2ncc[nH]2)n1.

What is the InChIKey of benzyl (2S)-2-amino-5-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-5-oxopentanoate;1-[4-[[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-2,2-dimethylpropan-1-one;[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-(1-methylcyclohexyl)methanone;2-N-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methyl]-2-N-(1H-imidazol-2-ylmethyl)-4-N-piperidin-4-ylpyrimidine-2,4-diamine;ethyl 4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidine-1-carboxylate?

The InChIKey is SZXQRMMJWGWEJQ-OUMQCAPYSA-N. The full InChI is InChI=1S/C36H55N11O3.C32H54N10O.C30H52N10O.C29H50N10O.C28H46N12.C27H46N10O2/c37-32(35(49)50-27-28-9-3-1-4-10-28)13-14-34(48)46-23-16-30(17-24-46)42-33-15-21-40-36(43-33)41-25-31-26-47(45-44-31)22-8-19-38-18-7-20-39-29-11-5-2-6-12-29;1-32(15-6-3-7-16-32)30(43)41-22-13-27(14-23-41)37-29-12-20-35-31(38-29)36-24-28-25-42(40-39-28)21-9-18-33-17-8-19-34-26-10-4-2-5-11-26;1-30(2,3)28(41)39-19-12-24(13-20-39)21-34-27-11-17-33-29(36-27)35-22-26-23-40(38-37-26)18-8-15-31-14-7-16-32-25-9-5-4-6-10-25;1-29(2,3)27(40)38-19-12-24(13-20-38)34-26-11-17-32-28(35-26)33-21-25-22-39(37-36-25)18-8-15-30-14-7-16-31-23-9-5-4-6-10-23;1-2-6-23(7-3-1)31-13-4-11-29-12-5-19-40-21-25(37-38-40)20-39(22-27-32-17-18-33-27)28-34-16-10-26(36-28)35-24-8-14-30-15-9-24;1-2-39-27(38)36-18-11-23(12-19-36)32-25-10-16-30-26(33-25)31-20-24-21-37(35-34-24)17-7-14-28-13-6-15-29-22-8-4-3-5-9-22/h1,3-4,9-10,15,21,26,29-30,32,38-39H,2,5-8,11-14,16-20,22-25,27,37H2,(H2,40,41,42,43);12,20,25-27,33-34H,2-11,13-19,21-24H2,1H3,(H2,35,36,37,38);11,17,23-25,31-32H,4-10,12-16,18-22H2,1-3H3,(H2,33,34,35,36);11,17,22-24,30-31H,4-10,12-16,18-21H2,1-3H3,(H2,32,33,34,35);10,16-18,21,23-24,29-31H,1-9,11-15,19-20,22H2,(H,32,33)(H,34,35,36);10,16,21-23,28-29H,2-9,11-15,17-20H2,1H3,(H2,30,31,32,33)/t32-;;;;;/m0...../s1.

What are the key properties of benzyl (2S)-2-amino-5-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-5-oxopentanoate;1-[4-[[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-2,2-dimethylpropan-1-one;[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-(1-methylcyclohexyl)methanone;2-N-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methyl]-2-N-(1H-imidazol-2-ylmethyl)-4-N-piperidin-4-ylpyrimidine-2,4-diamine;ethyl 4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidine-1-carboxylate?

benzyl (2S)-2-amino-5-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-5-oxopentanoate;1-[4-[[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-2,2-dimethylpropan-1-one;[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-(1-methylcyclohexyl)methanone;2-N-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methyl]-2-N-(1H-imidazol-2-ylmethyl)-4-N-piperidin-4-ylpyrimidine-2,4-diamine;ethyl 4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidine-1-carboxylate has a molecular weight of 3501.86 g/mol, XLogP of 20.12, 95 rotatable bonds, 26 hydrogen bond donors, and 65 hydrogen bond acceptors.

Where does this data come from?

All data for benzyl (2S)-2-amino-5-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-5-oxopentanoate;1-[4-[[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-2,2-dimethylpropan-1-one;[4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidin-1-yl]-(1-methylcyclohexyl)methanone;2-N-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methyl]-2-N-(1H-imidazol-2-ylmethyl)-4-N-piperidin-4-ylpyrimidine-2,4-diamine;ethyl 4-[[2-[[1-[3-[3-(cyclohexylamino)propylamino]propyl]triazol-4-yl]methylamino]pyrimidin-4-yl]amino]piperidine-1-carboxylate is sourced from PubChem (CID 160984325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).