General Information of the Compound
| Compound ID |
CP0530276
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| Compound Name |
2-(4-((1-(4-chlorophenoxy)-3-(1-methylpiperazine-4-carbonyl)-9H-carbazol-9-yl)methyl)piperidin-1-yl)-N,N-dimethylacetamide
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| Structure |
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| Formula |
C34H40ClN5O3
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| Molecular Weight |
602.179
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| Canonical SMILES |
CN(C)C(=O)CN1CCC(Cn2c3ccccc3c3cc(cc(Oc4ccc(Cl)cc4)c23)C(=O)N2CCN(C)CC2)CC1
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| InChI |
InChI=1S/C34H40ClN5O3/c1-36(2)32(41)23-38-14-12-24(13-15-38)22-40-30-7-5-4-6-28(30)29-20-25(34(42)39-18-16-37(3)17-19-39)21-31(33(29)40)43-27-10-8-26(35)9-11-27/h4-11,20-21,24H,12-19,22-23H2,1-3H3
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| InChIKey |
UFNQEGHYWQYWSB-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