1-[2-[(3R,5S)-4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]-3,5-dimethylpiperazin-1-yl]ethoxy]-3,3-dimethylbutan-2-one;1-[4-[[4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]piperazin-1-yl]methyl]piperidin-1-yl]-3,3-dimethylbutan-2-one;1-[4-[2-[1-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]pyrrolidin-3-yl]ethyl]piperazin-1-yl]-3,3-dimethylbutan-2-one;3-methyl-1-[(1S,4S)-5-[3-[3-(2-methylpropanoyl)phenyl]propyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]butan-2-one;3-methyl-1-[(4-phenoxyphenyl)methoxy]butan-2-one;3-methyl-1-[2-[(6-phenyl-3-pyridinyl)oxy]ethoxy]butan-2-one;3-methyl-1-[3-[1-(2-propan-2-yloxyethyl)pyrazol-4-yl]cyclohexa-2,4-dien-1-yl]butan-2-one;2-methyl-1-[6-[3-[[4-(2-propan-2-yl-1H-pyrazol-2-ium-4-yl)-2-pyridinyl]oxy]azetidin-1-yl]-3-pyridinyl]propan-1-one

C177H254N21O19+ — CID 157419064

About 1-[2-[(3R,5S)-4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]-3,5-dimethylpiperazin-1-yl]ethoxy]-3,3-dimethylbutan-2-one;1-[4-[[4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]piperazin-1-yl]methyl]piperidin-1-yl]-3,3-dimethylbutan-2-one;1-[4-[2-[1-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]pyrrolidin-3-yl]ethyl]piperazin-1-yl]-3,3-dimethylbutan-2-one;3-methyl-1-[(1S,4S)-5-[3-[3-(2-methylpropanoyl)phenyl]propyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]butan-2-one;3-methyl-1-[(4-phenoxyphenyl)methoxy]butan-2-one;3-methyl-1-[2-[(6-phenyl-3-pyridinyl)oxy]ethoxy]butan-2-one;3-methyl-1-[3-[1-(2-propan-2-yloxyethyl)pyrazol-4-yl]cyclohexa-2,4-dien-1-yl]butan-2-one;2-methyl-1-[6-[3-[[4-(2-propan-2-yl-1H-pyrazol-2-ium-4-yl)-2-pyridinyl]oxy]azetidin-1-yl]-3-pyridinyl]propan-1-one

1-[2-[(3R,5S)-4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]-3,5-dimethylpiperazin-1-yl]ethoxy]-3,3-dimethylbutan-2-one;1-[4-[[4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]piperazin-1-yl]methyl]piperidin-1-yl]-3,3-dimethylbutan-2-one;1-[4-[2-[1-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]pyrrolidin-3-yl]ethyl]piperazin-1-yl]-3,3-dimethylbutan-2-one;3-methyl-1-[(1S,4S)-5-[3-[3-(2-methylpropanoyl)phenyl]propyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]butan-2-one;3-methyl-1-[(4-phenoxyphenyl)methoxy]butan-2-one;3-methyl-1-[2-[(6-phenyl-3-pyridinyl)oxy]ethoxy]butan-2-one;3-methyl-1-[3-[1-(2-propan-2-yloxyethyl)pyrazol-4-yl]cyclohexa-2,4-dien-1-yl]butan-2-one;2-methyl-1-[6-[3-[[4-(2-propan-2-yl-1H-pyrazol-2-ium-4-yl)-2-pyridinyl]oxy]azetidin-1-yl]-3-pyridinyl]propan-1-one (PubChem CID 157419064) has the molecular formula C177H254N21O19+ and a molecular weight of 2980.11 g/mol. Its IUPAC name is 1-[2-[(3R,5S)-4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]-3,5-dimethylpiperazin-1-yl]ethoxy]-3,3-dimethylbutan-2-one;1-[4-[[4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]piperazin-1-yl]methyl]piperidin-1-yl]-3,3-dimethylbutan-2-one;1-[4-[2-[1-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]pyrrolidin-3-yl]ethyl]piperazin-1-yl]-3,3-dimethylbutan-2-one;3-methyl-1-[(1S,4S)-5-[3-[3-(2-methylpropanoyl)phenyl]propyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]butan-2-one;3-methyl-1-[(4-phenoxyphenyl)methoxy]butan-2-one;3-methyl-1-[2-[(6-phenyl-3-pyridinyl)oxy]ethoxy]butan-2-one;3-methyl-1-[3-[1-(2-propan-2-yloxyethyl)pyrazol-4-yl]cyclohexa-2,4-dien-1-yl]butan-2-one;2-methyl-1-[6-[3-[[4-(2-propan-2-yl-1H-pyrazol-2-ium-4-yl)-2-pyridinyl]oxy]azetidin-1-yl]-3-pyridinyl]propan-1-one.

Molecular Properties

• Compound Name: 1-[2-[(3R,5S)-4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]-3,5-dimethylpiperazin-1-yl]ethoxy]-3,3-dimethylbutan-2-one;1-[4-[[4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]piperazin-1-yl]methyl]piperidin-1-yl]-3,3-dimethylbutan-2-one;1-[4-[2-[1-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]pyrrolidin-3-yl]ethyl]piperazin-1-yl]-3,3-dimethylbutan-2-one;3-methyl-1-[(1S,4S)-5-[3-[3-(2-methylpropanoyl)phenyl]propyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]butan-2-one;3-methyl-1-[(4-phenoxyphenyl)methoxy]butan-2-one;3-methyl-1-[2-[(6-phenyl-3-pyridinyl)oxy]ethoxy]butan-2-one;3-methyl-1-[3-[1-(2-propan-2-yloxyethyl)pyrazol-4-yl]cyclohexa-2,4-dien-1-yl]butan-2-one;2-methyl-1-[6-[3-[[4-(2-propan-2-yl-1H-pyrazol-2-ium-4-yl)-2-pyridinyl]oxy]azetidin-1-yl]-3-pyridinyl]propan-1-one
• PubChem CID: 157419064
• Molecular Formula: C177H254N21O19+
• Molecular Weight: 2980.11 g/mol
• Exact Mass: 2977.95
• IUPAC Name: 1-[2-[(3R,5S)-4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]-3,5-dimethylpiperazin-1-yl]ethoxy]-3,3-dimethylbutan-2-one;1-[4-[[4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]piperazin-1-yl]methyl]piperidin-1-yl]-3,3-dimethylbutan-2-one;1-[4-[2-[1-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]pyrrolidin-3-yl]ethyl]piperazin-1-yl]-3,3-dimethylbutan-2-one;3-methyl-1-[(1S,4S)-5-[3-[3-(2-methylpropanoyl)phenyl]propyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]butan-2-one;3-methyl-1-[(4-phenoxyphenyl)methoxy]butan-2-one;3-methyl-1-[2-[(6-phenyl-3-pyridinyl)oxy]ethoxy]butan-2-one;3-methyl-1-[3-[1-(2-propan-2-yloxyethyl)pyrazol-4-yl]cyclohexa-2,4-dien-1-yl]butan-2-one;2-methyl-1-[6-[3-[[4-(2-propan-2-yl-1H-pyrazol-2-ium-4-yl)-2-pyridinyl]oxy]azetidin-1-yl]-3-pyridinyl]propan-1-one
• SMILES: CC(C)(C)C(=O)CN1CCC(CN2CCN(c3ccc(C(=O)C(C)(C)C)cn3)CC2)CC1.CC(C)(C)C(=O)CN1CCN(CCC2CCN(c3ccc(C(=O)C(C)(C)C)cn3)C2)CC1.CC(C)C(=O)CN1C[C@@H]2C[C@H]1CN2CCCc1cccc(C(=O)C(C)C)c1.CC(C)C(=O)COCCOc1ccc(-c2ccccc2)nc1.CC(C)C(=O)COCc1ccc(Oc2ccccc2)cc1.CC(C)C(=O)c1ccc(N2CC(Oc3cc(-c4c[nH][n+](C(C)C)c4)ccn3)C2)nc1.CC(C)OCCn1cc(C2=CC(CC(=O)C(C)C)CC=C2)cn1.C[C@@H]1CN(CCOCC(=O)C(C)(C)C)C[C@H](C)N1c1ccc(C(=O)C(C)(C)C)cn1
• InChI: InChI=1S/2C26H42N4O2.C24H39N3O3.C23H27N5O2.C23H34N2O2.C19H28N2O2.C18H21NO3.C18H20O3/c1-25(2,3)22(31)19-29-15-13-28(14-16-29)11-9-20-10-12-30(18-20)23-8-7-21(17-27-23)24(32)26(4,5)6;1-25(2,3)22(31)19-28-11-9-20(10-12-28)18-29-13-15-30(16-14-29)23-8-7-21(17-27-23)24(32)26(4,5)6;1-17-14-26(11-12-30-16-20(28)23(3,4)5)15-18(2)27(17)21-10-9-19(13-25-21)22(29)24(6,7)8;1-15(2)23(29)18-5-6-21(25-10-18)27-13-20(14-27)30-22-9-17(7-8-24-22)19-11-26-28(12-19)16(3)4;1-16(2)22(26)15-25-14-20-12-21(25)13-24(20)10-6-8-18-7-5-9-19(11-18)23(27)17(3)4;1-14(2)19(22)11-16-6-5-7-17(10-16)18-12-20-21(13-18)8-9-23-15(3)4;1-14(2)18(20)13-21-10-11-22-16-8-9-17(19-12-16)15-6-4-3-5-7-15;1-14(2)18(19)13-20-12-15-8-10-17(11-9-15)21-16-6-4-3-5-7-16/h2*7-8,17,20H,9-16,18-19H2,1-6H3;9-10,13,17-18H,11-12,14-16H2,1-8H3;5-12,15-16,20H,13-14H2,1-4H3;5,7,9,11,16-17,20-21H,6,8,10,12-15H2,1-4H3;5,7,10,12-16H,6,8-9,11H2,1-4H3;3-9,12,14H,10-11,13H2,1-2H3;3-11,14H,12-13H2,1-2H3/p+1/t;;17-,18+;;20-,21-;;;/m....0.../s1
• InChIKey: NMZDTTDIFRDUGC-JLTBCPGBSA-O
• XLogP: 29.72
• TPSA: 419.92 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 38
• Rotatable Bonds: 59
• Heavy Atoms: 217
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2980.11
LogP ≤ 5	29.72
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	38

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(3R,5S)-4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]-3,5-dimethylpiperazin-1-yl]ethoxy]-3,3-dimethylbutan-2-one;1-[4-[[4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]piperazin-1-yl]methyl]piperidin-1-yl]-3,3-dimethylbutan-2-one;1-[4-[2-[1-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]pyrrolidin-3-yl]ethyl]piperazin-1-yl]-3,3-dimethylbutan-2-one;3-methyl-1-[(1S,4S)-5-[3-[3-(2-methylpropanoyl)phenyl]propyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]butan-2-one;3-methyl-1-[(4-phenoxyphenyl)methoxy]butan-2-one;3-methyl-1-[2-[(6-phenyl-3-pyridinyl)oxy]ethoxy]butan-2-one;3-methyl-1-[3-[1-(2-propan-2-yloxyethyl)pyrazol-4-yl]cyclohexa-2,4-dien-1-yl]butan-2-one;2-methyl-1-[6-[3-[[4-(2-propan-2-yl-1H-pyrazol-2-ium-4-yl)-2-pyridinyl]oxy]azetidin-1-yl]-3-pyridinyl]propan-1-one?

The IUPAC name of 1-[2-[(3R,5S)-4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]-3,5-dimethylpiperazin-1-yl]ethoxy]-3,3-dimethylbutan-2-one;1-[4-[[4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]piperazin-1-yl]methyl]piperidin-1-yl]-3,3-dimethylbutan-2-one;1-[4-[2-[1-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]pyrrolidin-3-yl]ethyl]piperazin-1-yl]-3,3-dimethylbutan-2-one;3-methyl-1-[(1S,4S)-5-[3-[3-(2-methylpropanoyl)phenyl]propyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]butan-2-one;3-methyl-1-[(4-phenoxyphenyl)methoxy]butan-2-one;3-methyl-1-[2-[(6-phenyl-3-pyridinyl)oxy]ethoxy]butan-2-one;3-methyl-1-[3-[1-(2-propan-2-yloxyethyl)pyrazol-4-yl]cyclohexa-2,4-dien-1-yl]butan-2-one;2-methyl-1-[6-[3-[[4-(2-propan-2-yl-1H-pyrazol-2-ium-4-yl)-2-pyridinyl]oxy]azetidin-1-yl]-3-pyridinyl]propan-1-one (CID 157419064) is 1-[2-[(3R,5S)-4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]-3,5-dimethylpiperazin-1-yl]ethoxy]-3,3-dimethylbutan-2-one;1-[4-[[4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]piperazin-1-yl]methyl]piperidin-1-yl]-3,3-dimethylbutan-2-one;1-[4-[2-[1-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]pyrrolidin-3-yl]ethyl]piperazin-1-yl]-3,3-dimethylbutan-2-one;3-methyl-1-[(1S,4S)-5-[3-[3-(2-methylpropanoyl)phenyl]propyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]butan-2-one;3-methyl-1-[(4-phenoxyphenyl)methoxy]butan-2-one;3-methyl-1-[2-[(6-phenyl-3-pyridinyl)oxy]ethoxy]butan-2-one;3-methyl-1-[3-[1-(2-propan-2-yloxyethyl)pyrazol-4-yl]cyclohexa-2,4-dien-1-yl]butan-2-one;2-methyl-1-[6-[3-[[4-(2-propan-2-yl-1H-pyrazol-2-ium-4-yl)-2-pyridinyl]oxy]azetidin-1-yl]-3-pyridinyl]propan-1-one.

What is the SMILES notation for 1-[2-[(3R,5S)-4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]-3,5-dimethylpiperazin-1-yl]ethoxy]-3,3-dimethylbutan-2-one;1-[4-[[4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]piperazin-1-yl]methyl]piperidin-1-yl]-3,3-dimethylbutan-2-one;1-[4-[2-[1-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]pyrrolidin-3-yl]ethyl]piperazin-1-yl]-3,3-dimethylbutan-2-one;3-methyl-1-[(1S,4S)-5-[3-[3-(2-methylpropanoyl)phenyl]propyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]butan-2-one;3-methyl-1-[(4-phenoxyphenyl)methoxy]butan-2-one;3-methyl-1-[2-[(6-phenyl-3-pyridinyl)oxy]ethoxy]butan-2-one;3-methyl-1-[3-[1-(2-propan-2-yloxyethyl)pyrazol-4-yl]cyclohexa-2,4-dien-1-yl]butan-2-one;2-methyl-1-[6-[3-[[4-(2-propan-2-yl-1H-pyrazol-2-ium-4-yl)-2-pyridinyl]oxy]azetidin-1-yl]-3-pyridinyl]propan-1-one?

The canonical SMILES for 1-[2-[(3R,5S)-4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]-3,5-dimethylpiperazin-1-yl]ethoxy]-3,3-dimethylbutan-2-one;1-[4-[[4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]piperazin-1-yl]methyl]piperidin-1-yl]-3,3-dimethylbutan-2-one;1-[4-[2-[1-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]pyrrolidin-3-yl]ethyl]piperazin-1-yl]-3,3-dimethylbutan-2-one;3-methyl-1-[(1S,4S)-5-[3-[3-(2-methylpropanoyl)phenyl]propyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]butan-2-one;3-methyl-1-[(4-phenoxyphenyl)methoxy]butan-2-one;3-methyl-1-[2-[(6-phenyl-3-pyridinyl)oxy]ethoxy]butan-2-one;3-methyl-1-[3-[1-(2-propan-2-yloxyethyl)pyrazol-4-yl]cyclohexa-2,4-dien-1-yl]butan-2-one;2-methyl-1-[6-[3-[[4-(2-propan-2-yl-1H-pyrazol-2-ium-4-yl)-2-pyridinyl]oxy]azetidin-1-yl]-3-pyridinyl]propan-1-one is CC(C)(C)C(=O)CN1CCC(CN2CCN(c3ccc(C(=O)C(C)(C)C)cn3)CC2)CC1.CC(C)(C)C(=O)CN1CCN(CCC2CCN(c3ccc(C(=O)C(C)(C)C)cn3)C2)CC1.CC(C)C(=O)CN1C[C@@H]2C[C@H]1CN2CCCc1cccc(C(=O)C(C)C)c1.CC(C)C(=O)COCCOc1ccc(-c2ccccc2)nc1.CC(C)C(=O)COCc1ccc(Oc2ccccc2)cc1.CC(C)C(=O)c1ccc(N2CC(Oc3cc(-c4c[nH][n+](C(C)C)c4)ccn3)C2)nc1.CC(C)OCCn1cc(C2=CC(CC(=O)C(C)C)CC=C2)cn1.C[C@@H]1CN(CCOCC(=O)C(C)(C)C)C[C@H](C)N1c1ccc(C(=O)C(C)(C)C)cn1.

What is the InChIKey of 1-[2-[(3R,5S)-4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]-3,5-dimethylpiperazin-1-yl]ethoxy]-3,3-dimethylbutan-2-one;1-[4-[[4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]piperazin-1-yl]methyl]piperidin-1-yl]-3,3-dimethylbutan-2-one;1-[4-[2-[1-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]pyrrolidin-3-yl]ethyl]piperazin-1-yl]-3,3-dimethylbutan-2-one;3-methyl-1-[(1S,4S)-5-[3-[3-(2-methylpropanoyl)phenyl]propyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]butan-2-one;3-methyl-1-[(4-phenoxyphenyl)methoxy]butan-2-one;3-methyl-1-[2-[(6-phenyl-3-pyridinyl)oxy]ethoxy]butan-2-one;3-methyl-1-[3-[1-(2-propan-2-yloxyethyl)pyrazol-4-yl]cyclohexa-2,4-dien-1-yl]butan-2-one;2-methyl-1-[6-[3-[[4-(2-propan-2-yl-1H-pyrazol-2-ium-4-yl)-2-pyridinyl]oxy]azetidin-1-yl]-3-pyridinyl]propan-1-one?

The InChIKey is NMZDTTDIFRDUGC-JLTBCPGBSA-O. The full InChI is InChI=1S/2C26H42N4O2.C24H39N3O3.C23H27N5O2.C23H34N2O2.C19H28N2O2.C18H21NO3.C18H20O3/c1-25(2,3)22(31)19-29-15-13-28(14-16-29)11-9-20-10-12-30(18-20)23-8-7-21(17-27-23)24(32)26(4,5)6;1-25(2,3)22(31)19-28-11-9-20(10-12-28)18-29-13-15-30(16-14-29)23-8-7-21(17-27-23)24(32)26(4,5)6;1-17-14-26(11-12-30-16-20(28)23(3,4)5)15-18(2)27(17)21-10-9-19(13-25-21)22(29)24(6,7)8;1-15(2)23(29)18-5-6-21(25-10-18)27-13-20(14-27)30-22-9-17(7-8-24-22)19-11-26-28(12-19)16(3)4;1-16(2)22(26)15-25-14-20-12-21(25)13-24(20)10-6-8-18-7-5-9-19(11-18)23(27)17(3)4;1-14(2)19(22)11-16-6-5-7-17(10-16)18-12-20-21(13-18)8-9-23-15(3)4;1-14(2)18(20)13-21-10-11-22-16-8-9-17(19-12-16)15-6-4-3-5-7-15;1-14(2)18(19)13-20-12-15-8-10-17(11-9-15)21-16-6-4-3-5-7-16/h2*7-8,17,20H,9-16,18-19H2,1-6H3;9-10,13,17-18H,11-12,14-16H2,1-8H3;5-12,15-16,20H,13-14H2,1-4H3;5,7,9,11,16-17,20-21H,6,8,10,12-15H2,1-4H3;5,7,10,12-16H,6,8-9,11H2,1-4H3;3-9,12,14H,10-11,13H2,1-2H3;3-11,14H,12-13H2,1-2H3/p+1/t;;17-,18+;;20-,21-;;;/m....0.../s1.

What are the key properties of 1-[2-[(3R,5S)-4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]-3,5-dimethylpiperazin-1-yl]ethoxy]-3,3-dimethylbutan-2-one;1-[4-[[4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]piperazin-1-yl]methyl]piperidin-1-yl]-3,3-dimethylbutan-2-one;1-[4-[2-[1-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]pyrrolidin-3-yl]ethyl]piperazin-1-yl]-3,3-dimethylbutan-2-one;3-methyl-1-[(1S,4S)-5-[3-[3-(2-methylpropanoyl)phenyl]propyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]butan-2-one;3-methyl-1-[(4-phenoxyphenyl)methoxy]butan-2-one;3-methyl-1-[2-[(6-phenyl-3-pyridinyl)oxy]ethoxy]butan-2-one;3-methyl-1-[3-[1-(2-propan-2-yloxyethyl)pyrazol-4-yl]cyclohexa-2,4-dien-1-yl]butan-2-one;2-methyl-1-[6-[3-[[4-(2-propan-2-yl-1H-pyrazol-2-ium-4-yl)-2-pyridinyl]oxy]azetidin-1-yl]-3-pyridinyl]propan-1-one?

1-[2-[(3R,5S)-4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]-3,5-dimethylpiperazin-1-yl]ethoxy]-3,3-dimethylbutan-2-one;1-[4-[[4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]piperazin-1-yl]methyl]piperidin-1-yl]-3,3-dimethylbutan-2-one;1-[4-[2-[1-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]pyrrolidin-3-yl]ethyl]piperazin-1-yl]-3,3-dimethylbutan-2-one;3-methyl-1-[(1S,4S)-5-[3-[3-(2-methylpropanoyl)phenyl]propyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]butan-2-one;3-methyl-1-[(4-phenoxyphenyl)methoxy]butan-2-one;3-methyl-1-[2-[(6-phenyl-3-pyridinyl)oxy]ethoxy]butan-2-one;3-methyl-1-[3-[1-(2-propan-2-yloxyethyl)pyrazol-4-yl]cyclohexa-2,4-dien-1-yl]butan-2-one;2-methyl-1-[6-[3-[[4-(2-propan-2-yl-1H-pyrazol-2-ium-4-yl)-2-pyridinyl]oxy]azetidin-1-yl]-3-pyridinyl]propan-1-one has a molecular weight of 2980.11 g/mol, XLogP of 29.72, 59 rotatable bonds, 1 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[2-[(3R,5S)-4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]-3,5-dimethylpiperazin-1-yl]ethoxy]-3,3-dimethylbutan-2-one;1-[4-[[4-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]piperazin-1-yl]methyl]piperidin-1-yl]-3,3-dimethylbutan-2-one;1-[4-[2-[1-[5-(2,2-dimethylpropanoyl)-2-pyridinyl]pyrrolidin-3-yl]ethyl]piperazin-1-yl]-3,3-dimethylbutan-2-one;3-methyl-1-[(1S,4S)-5-[3-[3-(2-methylpropanoyl)phenyl]propyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]butan-2-one;3-methyl-1-[(4-phenoxyphenyl)methoxy]butan-2-one;3-methyl-1-[2-[(6-phenyl-3-pyridinyl)oxy]ethoxy]butan-2-one;3-methyl-1-[3-[1-(2-propan-2-yloxyethyl)pyrazol-4-yl]cyclohexa-2,4-dien-1-yl]butan-2-one;2-methyl-1-[6-[3-[[4-(2-propan-2-yl-1H-pyrazol-2-ium-4-yl)-2-pyridinyl]oxy]azetidin-1-yl]-3-pyridinyl]propan-1-one is sourced from PubChem (CID 157419064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).