General Information of the Compound
| Compound ID |
CP0150798
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| Compound Name |
N-[[4-(1H-indol-5-yl)phenyl]methyl]-3-methyl-3-phenylpiperidine-1-carboxamide
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| Structure |
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| Formula |
C28H29N3O
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| Molecular Weight |
423.56
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| Canonical SMILES |
CC1(CCCN(C1)C(=O)NCc1ccc(cc1)-c1ccc2[nH]ccc2c1)c1ccccc1
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| InChI |
InChI=1S/C28H29N3O/c1-28(25-6-3-2-4-7-25)15-5-17-31(20-28)27(32)30-19-21-8-10-22(11-9-21)23-12-13-26-24(18-23)14-16-29-26/h2-4,6-14,16,18,29H,5,15,17,19-20H2,1H3,(H,30,32)
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| InChIKey |
HIQKQNMARNQIET-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