General Information of the Compound
| Compound ID |
CP0519316
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| Compound Name |
1-[3-(N-(1-acetylpiperidine-4-carbonyl)-3-chloroanilino)propyl]-N-[(4-chlorophenyl)methyl]piperidine-4-carboxamide
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| Structure |
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| Formula |
C30H38Cl2N4O3
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| Molecular Weight |
573.565
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| Canonical SMILES |
CC(=O)N1CCC(CC1)C(=O)N(CCCN1CCC(CC1)C(=O)NCc1ccc(Cl)cc1)c1cccc(Cl)c1
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| InChI |
InChI=1S/C30H38Cl2N4O3/c1-22(37)35-18-12-25(13-19-35)30(39)36(28-5-2-4-27(32)20-28)15-3-14-34-16-10-24(11-17-34)29(38)33-21-23-6-8-26(31)9-7-23/h2,4-9,20,24-25H,3,10-19,21H2,1H3,(H,33,38)
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| InChIKey |
FIOVRQYTOCQIIS-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound