General Information of the Compound
| Compound ID |
CP0435725
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| Compound Name |
(1R)-1-(4-chlorophenoxy)-9-(3-piperidin-1-ylpropyl)-2,3-dihydro-1H-carbazol-4-one
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| Structure |
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| Formula |
C26H29ClN2O2
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| Molecular Weight |
436.983
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| Canonical SMILES |
Clc1ccc(O[C@@H]2CCC(=O)c3c2n(CCCN2CCCCC2)c2ccccc32)cc1
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| InChI |
InChI=1S/C26H29ClN2O2/c27-19-9-11-20(12-10-19)31-24-14-13-23(30)25-21-7-2-3-8-22(21)29(26(24)25)18-6-17-28-15-4-1-5-16-28/h2-3,7-12,24H,1,4-6,13-18H2/t24-/m1/s1
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| InChIKey |
ZWWDBHPYMHQUBH-XMMPIXPASA-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