General Information of the Compound
| Compound ID |
CP0322328
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| Compound Name |
1-Acetyl-2-[exo-8-[bis(2-chlorophenyl)methyl]-8-azabicyclo[3.2.1]-oct-3-yl]piperidine
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| Structure |
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| Formula |
C27H32Cl2N2O
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| Molecular Weight |
471.472
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| Canonical SMILES |
CC(=O)N1CCCCC1C1C[C@@H]2CC[C@@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl
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| InChI |
InChI=1S/C27H32Cl2N2O/c1-18(32)30-15-7-6-12-26(30)19-16-20-13-14-21(17-19)31(20)27(22-8-2-4-10-24(22)28)23-9-3-5-11-25(23)29/h2-5,8-11,19-21,26-27H,6-7,12-17H2,1H3/t20-,21-,26?/m0/s1
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| InChIKey |
ZOKXPVBKMFHHNR-IPEYFGQDSA-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