General Information of the Compound
| Compound ID |
CP0365211
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| Compound Name |
N-(2-cyanophenyl)-N'-(9-ethylcarbazol-3-yl)-3-methylpentanediamide
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| Structure |
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| Formula |
C27H26N4O2
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| Molecular Weight |
438.531
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| Canonical SMILES |
CCn1c2ccccc2c2cc(NC(=O)CC(C)CC(=O)Nc3ccccc3C#N)ccc12
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| InChI |
InChI=1S/C27H26N4O2/c1-3-31-24-11-7-5-9-21(24)22-16-20(12-13-25(22)31)29-26(32)14-18(2)15-27(33)30-23-10-6-4-8-19(23)17-28/h4-13,16,18H,3,14-15H2,1-2H3,(H,29,32)(H,30,33)
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| InChIKey |
IAOVMIMNYRKNKT-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