General Information of the Compound
| Compound ID |
CP0412819
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| Compound Name |
N-(9-ethylcarbazol-3-yl)-N'-(4-fluorophenyl)-3-methylpentanediamide
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| Structure |
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| Formula |
C26H26FN3O2
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| Molecular Weight |
431.511
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| Canonical SMILES |
CCn1c2ccccc2c2cc(NC(=O)CC(C)CC(=O)Nc3ccc(F)cc3)ccc12
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| InChI |
InChI=1S/C26H26FN3O2/c1-3-30-23-7-5-4-6-21(23)22-16-20(12-13-24(22)30)29-26(32)15-17(2)14-25(31)28-19-10-8-18(27)9-11-19/h4-13,16-17H,3,14-15H2,1-2H3,(H,28,31)(H,29,32)
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| InChIKey |
JRDKQUXZRJEECP-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