2-chloro-4-[3-[4-methyl-6-[3-[[(2S)-2-methylpiperazin-1-yl]methyl]phenyl]pyrimidin-2-yl]propyl]phenol;N-[[3-[2-[3-(3,5-difluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]-N-[[(3S)-piperidin-3-yl]methyl]ethanamine;3-[3-[4-[5-[[(2S,5S)-2,5-dimethylpiperazin-1-yl]methyl]-2-methylphenyl]pyrimidin-2-yl]propyl]phenol;(3S)-N-ethyl-N-[[3-[2-[3-(3-fluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]pyrrolidin-3-amine;3-[1-[[3-[2-[3-(3-hydroxyphenyl)propyl]pyrimidin-4-yl]phenyl]methyl]piperazin-2-yl]propanoic acid;4-[3-[4-[4-methyl-3-(piperidin-4-ylamino)phenyl]pyrimidin-2-yl]propyl]phenol

C159H192ClF3N24O6 — CID 159083768

IUPAC2-chloro-4-[3-[4-methyl-6-[3-[[(2S)-2-methylpiperazin-1-yl]methyl]phenyl]pyrimidin-2-yl]propyl]phenol;N-[[3-[2-[3-(3,5-difluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]-N-[[(3S)-piperidin-3-yl]methyl]ethanamine;3-[3-[4-[5-[[(2S,5S)-2,5-dimethylpiperazin-1-yl]methyl]-2-methylphenyl]pyrimidin-2-yl]propyl]phenol;(3S)-N-ethyl-N-[[3-[2-[3-(3-fluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]pyrrolidin-3-amine;3-[1-[[3-[2-[3-(3-hydroxyphenyl)propyl]pyrimidin-4-yl]phenyl]methyl]piperazin-2-yl]propanoic acid;4-[3-[4-[4-methyl-3-(piperidin-4-ylamino)phenyl]pyrimidin-2-yl]propyl]phenol
SMILESCCN(Cc1cccc(-c2ccnc(CCCc3cc(F)cc(F)c3)n2)c1)C[C@H]1CCCNC1.CCN(Cc1cccc(-c2ccnc(CCCc3cccc(F)c3)n2)c1)[C@H]1CCNC1.Cc1cc(-c2cccc(CN3CCNC[C@@H]3C)c2)nc(CCCc2ccc(O)c(Cl)c2)n1.Cc1ccc(-c2ccnc(CCCc3ccc(O)cc3)n2)cc1NC1CCNCC1.Cc1ccc(CN2C[C@H](C)NC[C@@H]2C)cc1-c1ccnc(CCCc2cccc(O)c2)n1.O=C(O)CCC1CNCCN1Cc1cccc(-c2ccnc(CCCc3cccc(O)c3)n2)c1
InChIInChI=1S/C28H34F2N4.C27H32N4O3.C27H34N4O.C26H31ClN4O.C26H31FN4.C25H30N4O/c1-2-34(20-23-8-5-12-31-18-23)19-22-7-3-9-24(14-22)27-11-13-32-28(33-27)10-4-6-21-15-25(29)17-26(30)16-21;32-24-8-2-4-20(17-24)5-3-9-26-29-13-12-25(30-26)22-7-1-6-21(16-22)19-31-15-14-28-18-23(31)10-11-27(33)34;1-19-10-11-23(18-31-17-20(2)29-16-21(31)3)15-25(19)26-12-13-28-27(30-26)9-5-7-22-6-4-8-24(32)14-22;1-18-13-24(22-7-3-6-21(14-22)17-31-12-11-28-16-19(31)2)30-26(29-18)8-4-5-20-9-10-25(32)23(27)15-20;1-2-31(24-12-14-28-18-24)19-21-8-3-9-22(16-21)25-13-15-29-26(30-25)11-5-7-20-6-4-10-23(27)17-20;1-18-5-8-20(17-24(18)28-21-11-14-26-15-12-21)23-13-16-27-25(29-23)4-2-3-19-6-9-22(30)10-7-19/h3,7,9,11,13-17,23,31H,2,4-6,8,10,12,18-20H2,1H3;1-2,4,6-8,12-13,16-17,23,28,32H,3,5,9-11,14-15,18-19H2,(H,33,34);4,6,8,10-15,20-21,29,32H,5,7,9,16-18H2,1-3H3;3,6-7,9-10,13-15,19,28,32H,4-5,8,11-12,16-17H2,1-2H3;3-4,6,8-10,13,15-17,24,28H,2,5,7,11-12,14,18-19H2,1H3;5-10,13,16-17,21,26,28,30H,2-4,11-12,14-15H2,1H3/t23-;;20-,21-;19-;24-;/m0.000./s1
InChIKeyKBEKZBOKZYQHGU-GYYCXUSVSA-N
MW2627.89 g/mol
LogP27.52
Rot. Bonds50

About 2-chloro-4-[3-[4-methyl-6-[3-[[(2S)-2-methylpiperazin-1-yl]methyl]phenyl]pyrimidin-2-yl]propyl]phenol;N-[[3-[2-[3-(3,5-difluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]-N-[[(3S)-piperidin-3-yl]methyl]ethanamine;3-[3-[4-[5-[[(2S,5S)-2,5-dimethylpiperazin-1-yl]methyl]-2-methylphenyl]pyrimidin-2-yl]propyl]phenol;(3S)-N-ethyl-N-[[3-[2-[3-(3-fluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]pyrrolidin-3-amine;3-[1-[[3-[2-[3-(3-hydroxyphenyl)propyl]pyrimidin-4-yl]phenyl]methyl]piperazin-2-yl]propanoic acid;4-[3-[4-[4-methyl-3-(piperidin-4-ylamino)phenyl]pyrimidin-2-yl]propyl]phenol

2-chloro-4-[3-[4-methyl-6-[3-[[(2S)-2-methylpiperazin-1-yl]methyl]phenyl]pyrimidin-2-yl]propyl]phenol;N-[[3-[2-[3-(3,5-difluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]-N-[[(3S)-piperidin-3-yl]methyl]ethanamine;3-[3-[4-[5-[[(2S,5S)-2,5-dimethylpiperazin-1-yl]methyl]-2-methylphenyl]pyrimidin-2-yl]propyl]phenol;(3S)-N-ethyl-N-[[3-[2-[3-(3-fluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]pyrrolidin-3-amine;3-[1-[[3-[2-[3-(3-hydroxyphenyl)propyl]pyrimidin-4-yl]phenyl]methyl]piperazin-2-yl]propanoic acid;4-[3-[4-[4-methyl-3-(piperidin-4-ylamino)phenyl]pyrimidin-2-yl]propyl]phenol (PubChem CID 159083768) has the molecular formula C159H192ClF3N24O6 and a molecular weight of 2627.89 g/mol. Its IUPAC name is 2-chloro-4-[3-[4-methyl-6-[3-[[(2S)-2-methylpiperazin-1-yl]methyl]phenyl]pyrimidin-2-yl]propyl]phenol;N-[[3-[2-[3-(3,5-difluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]-N-[[(3S)-piperidin-3-yl]methyl]ethanamine;3-[3-[4-[5-[[(2S,5S)-2,5-dimethylpiperazin-1-yl]methyl]-2-methylphenyl]pyrimidin-2-yl]propyl]phenol;(3S)-N-ethyl-N-[[3-[2-[3-(3-fluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]pyrrolidin-3-amine;3-[1-[[3-[2-[3-(3-hydroxyphenyl)propyl]pyrimidin-4-yl]phenyl]methyl]piperazin-2-yl]propanoic acid;4-[3-[4-[4-methyl-3-(piperidin-4-ylamino)phenyl]pyrimidin-2-yl]propyl]phenol.

Molecular Properties

Compound Name2-chloro-4-[3-[4-methyl-6-[3-[[(2S)-2-methylpiperazin-1-yl]methyl]phenyl]pyrimidin-2-yl]propyl]phenol;N-[[3-[2-[3-(3,5-difluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]-N-[[(3S)-piperidin-3-yl]methyl]ethanamine;3-[3-[4-[5-[[(2S,5S)-2,5-dimethylpiperazin-1-yl]methyl]-2-methylphenyl]pyrimidin-2-yl]propyl]phenol;(3S)-N-ethyl-N-[[3-[2-[3-(3-fluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]pyrrolidin-3-amine;3-[1-[[3-[2-[3-(3-hydroxyphenyl)propyl]pyrimidin-4-yl]phenyl]methyl]piperazin-2-yl]propanoic acid;4-[3-[4-[4-methyl-3-(piperidin-4-ylamino)phenyl]pyrimidin-2-yl]propyl]phenol
PubChem CID159083768
Molecular FormulaC159H192ClF3N24O6
Molecular Weight2627.89 g/mol
Exact Mass2625.51
IUPAC Name2-chloro-4-[3-[4-methyl-6-[3-[[(2S)-2-methylpiperazin-1-yl]methyl]phenyl]pyrimidin-2-yl]propyl]phenol;N-[[3-[2-[3-(3,5-difluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]-N-[[(3S)-piperidin-3-yl]methyl]ethanamine;3-[3-[4-[5-[[(2S,5S)-2,5-dimethylpiperazin-1-yl]methyl]-2-methylphenyl]pyrimidin-2-yl]propyl]phenol;(3S)-N-ethyl-N-[[3-[2-[3-(3-fluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]pyrrolidin-3-amine;3-[1-[[3-[2-[3-(3-hydroxyphenyl)propyl]pyrimidin-4-yl]phenyl]methyl]piperazin-2-yl]propanoic acid;4-[3-[4-[4-methyl-3-(piperidin-4-ylamino)phenyl]pyrimidin-2-yl]propyl]phenol
SMILESCCN(Cc1cccc(-c2ccnc(CCCc3cc(F)cc(F)c3)n2)c1)C[C@H]1CCCNC1.CCN(Cc1cccc(-c2ccnc(CCCc3cccc(F)c3)n2)c1)[C@H]1CCNC1.Cc1cc(-c2cccc(CN3CCNC[C@@H]3C)c2)nc(CCCc2ccc(O)c(Cl)c2)n1.Cc1ccc(-c2ccnc(CCCc3ccc(O)cc3)n2)cc1NC1CCNCC1.Cc1ccc(CN2C[C@H](C)NC[C@@H]2C)cc1-c1ccnc(CCCc2cccc(O)c2)n1.O=C(O)CCC1CNCCN1Cc1cccc(-c2ccnc(CCCc3cccc(O)c3)n2)c1
InChIInChI=1S/C28H34F2N4.C27H32N4O3.C27H34N4O.C26H31ClN4O.C26H31FN4.C25H30N4O/c1-2-34(20-23-8-5-12-31-18-23)19-22-7-3-9-24(14-22)27-11-13-32-28(33-27)10-4-6-21-15-25(29)17-26(30)16-21;32-24-8-2-4-20(17-24)5-3-9-26-29-13-12-25(30-26)22-7-1-6-21(16-22)19-31-15-14-28-18-23(31)10-11-27(33)34;1-19-10-11-23(18-31-17-20(2)29-16-21(31)3)15-25(19)26-12-13-28-27(30-26)9-5-7-22-6-4-8-24(32)14-22;1-18-13-24(22-7-3-6-21(14-22)17-31-12-11-28-16-19(31)2)30-26(29-18)8-4-5-20-9-10-25(32)23(27)15-20;1-2-31(24-12-14-28-18-24)19-21-8-3-9-22(16-21)25-13-15-29-26(30-25)11-5-7-20-6-4-10-23(27)17-20;1-18-5-8-20(17-24(18)28-21-11-14-26-15-12-21)23-13-16-27-25(29-23)4-2-3-19-6-9-22(30)10-7-19/h3,7,9,11,13-17,23,31H,2,4-6,8,10,12,18-20H2,1H3;1-2,4,6-8,12-13,16-17,23,28,32H,3,5,9-11,14-15,18-19H2,(H,33,34);4,6,8,10-15,20-21,29,32H,5,7,9,16-18H2,1-3H3;3,6-7,9-10,13-15,19,28,32H,4-5,8,11-12,16-17H2,1-2H3;3-4,6,8-10,13,15-17,24,28H,2,5,7,11-12,14,18-19H2,1H3;5-10,13,16-17,21,26,28,30H,2-4,11-12,14-15H2,1H3/t23-;;20-,21-;19-;24-;/m0.000./s1
InChIKeyKBEKZBOKZYQHGU-GYYCXUSVSA-N
XLogP27.52
TPSA373.31 Ų
H-Bond Donors12
H-Bond Acceptors29
Rotatable Bonds50
Heavy Atoms193
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002627.89
LogP ≤ 527.52
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1029

Analyze 2-chloro-4-[3-[4-methyl-6-[3-[[(2S)-2-methylpiperazin-1-yl]methyl]phenyl]pyrimidin-2-yl]propyl]phenol;N-[[3-[2-[3-(3,5-difluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]-N-[[(3S)-piperidin-3-yl]methyl]ethanamine;3-[3-[4-[5-[[(2S,5S)-2,5-dimethylpiperazin-1-yl]methyl]-2-methylphenyl]pyrimidin-2-yl]propyl]phenol;(3S)-N-ethyl-N-[[3-[2-[3-(3-fluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]pyrrolidin-3-amine;3-[1-[[3-[2-[3-(3-hydroxyphenyl)propyl]pyrimidin-4-yl]phenyl]methyl]piperazin-2-yl]propanoic acid;4-[3-[4-[4-methyl-3-(piperidin-4-ylamino)phenyl]pyrimidin-2-yl]propyl]phenol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-[3-[4-methyl-6-[3-[[(2S)-2-methylpiperazin-1-yl]methyl]phenyl]pyrimidin-2-yl]propyl]phenol;N-[[3-[2-[3-(3,5-difluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]-N-[[(3S)-piperidin-3-yl]methyl]ethanamine;3-[3-[4-[5-[[(2S,5S)-2,5-dimethylpiperazin-1-yl]methyl]-2-methylphenyl]pyrimidin-2-yl]propyl]phenol;(3S)-N-ethyl-N-[[3-[2-[3-(3-fluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]pyrrolidin-3-amine;3-[1-[[3-[2-[3-(3-hydroxyphenyl)propyl]pyrimidin-4-yl]phenyl]methyl]piperazin-2-yl]propanoic acid;4-[3-[4-[4-methyl-3-(piperidin-4-ylamino)phenyl]pyrimidin-2-yl]propyl]phenol?
The IUPAC name of 2-chloro-4-[3-[4-methyl-6-[3-[[(2S)-2-methylpiperazin-1-yl]methyl]phenyl]pyrimidin-2-yl]propyl]phenol;N-[[3-[2-[3-(3,5-difluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]-N-[[(3S)-piperidin-3-yl]methyl]ethanamine;3-[3-[4-[5-[[(2S,5S)-2,5-dimethylpiperazin-1-yl]methyl]-2-methylphenyl]pyrimidin-2-yl]propyl]phenol;(3S)-N-ethyl-N-[[3-[2-[3-(3-fluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]pyrrolidin-3-amine;3-[1-[[3-[2-[3-(3-hydroxyphenyl)propyl]pyrimidin-4-yl]phenyl]methyl]piperazin-2-yl]propanoic acid;4-[3-[4-[4-methyl-3-(piperidin-4-ylamino)phenyl]pyrimidin-2-yl]propyl]phenol (CID 159083768) is 2-chloro-4-[3-[4-methyl-6-[3-[[(2S)-2-methylpiperazin-1-yl]methyl]phenyl]pyrimidin-2-yl]propyl]phenol;N-[[3-[2-[3-(3,5-difluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]-N-[[(3S)-piperidin-3-yl]methyl]ethanamine;3-[3-[4-[5-[[(2S,5S)-2,5-dimethylpiperazin-1-yl]methyl]-2-methylphenyl]pyrimidin-2-yl]propyl]phenol;(3S)-N-ethyl-N-[[3-[2-[3-(3-fluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]pyrrolidin-3-amine;3-[1-[[3-[2-[3-(3-hydroxyphenyl)propyl]pyrimidin-4-yl]phenyl]methyl]piperazin-2-yl]propanoic acid;4-[3-[4-[4-methyl-3-(piperidin-4-ylamino)phenyl]pyrimidin-2-yl]propyl]phenol.
What is the SMILES notation for 2-chloro-4-[3-[4-methyl-6-[3-[[(2S)-2-methylpiperazin-1-yl]methyl]phenyl]pyrimidin-2-yl]propyl]phenol;N-[[3-[2-[3-(3,5-difluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]-N-[[(3S)-piperidin-3-yl]methyl]ethanamine;3-[3-[4-[5-[[(2S,5S)-2,5-dimethylpiperazin-1-yl]methyl]-2-methylphenyl]pyrimidin-2-yl]propyl]phenol;(3S)-N-ethyl-N-[[3-[2-[3-(3-fluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]pyrrolidin-3-amine;3-[1-[[3-[2-[3-(3-hydroxyphenyl)propyl]pyrimidin-4-yl]phenyl]methyl]piperazin-2-yl]propanoic acid;4-[3-[4-[4-methyl-3-(piperidin-4-ylamino)phenyl]pyrimidin-2-yl]propyl]phenol?
The canonical SMILES for 2-chloro-4-[3-[4-methyl-6-[3-[[(2S)-2-methylpiperazin-1-yl]methyl]phenyl]pyrimidin-2-yl]propyl]phenol;N-[[3-[2-[3-(3,5-difluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]-N-[[(3S)-piperidin-3-yl]methyl]ethanamine;3-[3-[4-[5-[[(2S,5S)-2,5-dimethylpiperazin-1-yl]methyl]-2-methylphenyl]pyrimidin-2-yl]propyl]phenol;(3S)-N-ethyl-N-[[3-[2-[3-(3-fluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]pyrrolidin-3-amine;3-[1-[[3-[2-[3-(3-hydroxyphenyl)propyl]pyrimidin-4-yl]phenyl]methyl]piperazin-2-yl]propanoic acid;4-[3-[4-[4-methyl-3-(piperidin-4-ylamino)phenyl]pyrimidin-2-yl]propyl]phenol is CCN(Cc1cccc(-c2ccnc(CCCc3cc(F)cc(F)c3)n2)c1)C[C@H]1CCCNC1.CCN(Cc1cccc(-c2ccnc(CCCc3cccc(F)c3)n2)c1)[C@H]1CCNC1.Cc1cc(-c2cccc(CN3CCNC[C@@H]3C)c2)nc(CCCc2ccc(O)c(Cl)c2)n1.Cc1ccc(-c2ccnc(CCCc3ccc(O)cc3)n2)cc1NC1CCNCC1.Cc1ccc(CN2C[C@H](C)NC[C@@H]2C)cc1-c1ccnc(CCCc2cccc(O)c2)n1.O=C(O)CCC1CNCCN1Cc1cccc(-c2ccnc(CCCc3cccc(O)c3)n2)c1.
What is the InChIKey of 2-chloro-4-[3-[4-methyl-6-[3-[[(2S)-2-methylpiperazin-1-yl]methyl]phenyl]pyrimidin-2-yl]propyl]phenol;N-[[3-[2-[3-(3,5-difluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]-N-[[(3S)-piperidin-3-yl]methyl]ethanamine;3-[3-[4-[5-[[(2S,5S)-2,5-dimethylpiperazin-1-yl]methyl]-2-methylphenyl]pyrimidin-2-yl]propyl]phenol;(3S)-N-ethyl-N-[[3-[2-[3-(3-fluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]pyrrolidin-3-amine;3-[1-[[3-[2-[3-(3-hydroxyphenyl)propyl]pyrimidin-4-yl]phenyl]methyl]piperazin-2-yl]propanoic acid;4-[3-[4-[4-methyl-3-(piperidin-4-ylamino)phenyl]pyrimidin-2-yl]propyl]phenol?
The InChIKey is KBEKZBOKZYQHGU-GYYCXUSVSA-N. The full InChI is InChI=1S/C28H34F2N4.C27H32N4O3.C27H34N4O.C26H31ClN4O.C26H31FN4.C25H30N4O/c1-2-34(20-23-8-5-12-31-18-23)19-22-7-3-9-24(14-22)27-11-13-32-28(33-27)10-4-6-21-15-25(29)17-26(30)16-21;32-24-8-2-4-20(17-24)5-3-9-26-29-13-12-25(30-26)22-7-1-6-21(16-22)19-31-15-14-28-18-23(31)10-11-27(33)34;1-19-10-11-23(18-31-17-20(2)29-16-21(31)3)15-25(19)26-12-13-28-27(30-26)9-5-7-22-6-4-8-24(32)14-22;1-18-13-24(22-7-3-6-21(14-22)17-31-12-11-28-16-19(31)2)30-26(29-18)8-4-5-20-9-10-25(32)23(27)15-20;1-2-31(24-12-14-28-18-24)19-21-8-3-9-22(16-21)25-13-15-29-26(30-25)11-5-7-20-6-4-10-23(27)17-20;1-18-5-8-20(17-24(18)28-21-11-14-26-15-12-21)23-13-16-27-25(29-23)4-2-3-19-6-9-22(30)10-7-19/h3,7,9,11,13-17,23,31H,2,4-6,8,10,12,18-20H2,1H3;1-2,4,6-8,12-13,16-17,23,28,32H,3,5,9-11,14-15,18-19H2,(H,33,34);4,6,8,10-15,20-21,29,32H,5,7,9,16-18H2,1-3H3;3,6-7,9-10,13-15,19,28,32H,4-5,8,11-12,16-17H2,1-2H3;3-4,6,8-10,13,15-17,24,28H,2,5,7,11-12,14,18-19H2,1H3;5-10,13,16-17,21,26,28,30H,2-4,11-12,14-15H2,1H3/t23-;;20-,21-;19-;24-;/m0.000./s1.
What are the key properties of 2-chloro-4-[3-[4-methyl-6-[3-[[(2S)-2-methylpiperazin-1-yl]methyl]phenyl]pyrimidin-2-yl]propyl]phenol;N-[[3-[2-[3-(3,5-difluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]-N-[[(3S)-piperidin-3-yl]methyl]ethanamine;3-[3-[4-[5-[[(2S,5S)-2,5-dimethylpiperazin-1-yl]methyl]-2-methylphenyl]pyrimidin-2-yl]propyl]phenol;(3S)-N-ethyl-N-[[3-[2-[3-(3-fluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]pyrrolidin-3-amine;3-[1-[[3-[2-[3-(3-hydroxyphenyl)propyl]pyrimidin-4-yl]phenyl]methyl]piperazin-2-yl]propanoic acid;4-[3-[4-[4-methyl-3-(piperidin-4-ylamino)phenyl]pyrimidin-2-yl]propyl]phenol?
2-chloro-4-[3-[4-methyl-6-[3-[[(2S)-2-methylpiperazin-1-yl]methyl]phenyl]pyrimidin-2-yl]propyl]phenol;N-[[3-[2-[3-(3,5-difluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]-N-[[(3S)-piperidin-3-yl]methyl]ethanamine;3-[3-[4-[5-[[(2S,5S)-2,5-dimethylpiperazin-1-yl]methyl]-2-methylphenyl]pyrimidin-2-yl]propyl]phenol;(3S)-N-ethyl-N-[[3-[2-[3-(3-fluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]pyrrolidin-3-amine;3-[1-[[3-[2-[3-(3-hydroxyphenyl)propyl]pyrimidin-4-yl]phenyl]methyl]piperazin-2-yl]propanoic acid;4-[3-[4-[4-methyl-3-(piperidin-4-ylamino)phenyl]pyrimidin-2-yl]propyl]phenol has a molecular weight of 2627.89 g/mol, XLogP of 27.52, 50 rotatable bonds, 12 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-[3-[4-methyl-6-[3-[[(2S)-2-methylpiperazin-1-yl]methyl]phenyl]pyrimidin-2-yl]propyl]phenol;N-[[3-[2-[3-(3,5-difluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]-N-[[(3S)-piperidin-3-yl]methyl]ethanamine;3-[3-[4-[5-[[(2S,5S)-2,5-dimethylpiperazin-1-yl]methyl]-2-methylphenyl]pyrimidin-2-yl]propyl]phenol;(3S)-N-ethyl-N-[[3-[2-[3-(3-fluorophenyl)propyl]pyrimidin-4-yl]phenyl]methyl]pyrrolidin-3-amine;3-[1-[[3-[2-[3-(3-hydroxyphenyl)propyl]pyrimidin-4-yl]phenyl]methyl]piperazin-2-yl]propanoic acid;4-[3-[4-[4-methyl-3-(piperidin-4-ylamino)phenyl]pyrimidin-2-yl]propyl]phenol is sourced from PubChem (CID 159083768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).