General Information of the Compound
| Compound ID |
CP0900087
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| Compound Name |
1-{1-Phenyl-2-[4-(piperidin-1-yl)piperidin-1-yl]ethyl}-4-(propan-2-yl)piperazine
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| Structure |
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| Formula |
C25H42N4
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| Molecular Weight |
398.639
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| Canonical SMILES |
CC(C)N1CCN(C(CN2CCC(N3CCCCC3)CC2)c2ccccc2)CC1
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| InChI |
InChI=1S/C25H42N4/c1-22(2)27-17-19-29(20-18-27)25(23-9-5-3-6-10-23)21-26-15-11-24(12-16-26)28-13-7-4-8-14-28/h3,5-6,9-10,22,24-25H,4,7-8,11-21H2,1-2H3
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| InChIKey |
AZOCNPRRDOKGLE-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