General Information of the Compound
| Compound ID |
CP0427680
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| Compound Name |
(1-(4-chlorophenoxy)-9-(piperidin-3-ylmethyl)-9H-carbazol-3-yl)(4-methylpiperazin-1-yl)methanone
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| Structure |
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| Formula |
C30H33ClN4O2
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| Molecular Weight |
517.073
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| Canonical SMILES |
CN1CCN(CC1)C(=O)c1cc(Oc2ccc(Cl)cc2)c2n(CC3CCCNC3)c3ccccc3c2c1
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| InChI |
InChI=1S/C30H33ClN4O2/c1-33-13-15-34(16-14-33)30(36)22-17-26-25-6-2-3-7-27(25)35(20-21-5-4-12-32-19-21)29(26)28(18-22)37-24-10-8-23(31)9-11-24/h2-3,6-11,17-18,21,32H,4-5,12-16,19-20H2,1H3
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| InChIKey |
WDBDCRKFWGOAAP-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