General Information of the Compound
| Compound ID |
CP0412820
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| Compound Name |
N-(4-cyanophenyl)-N'-(9-ethylcarbazol-3-yl)-N,N',3-trimethylpentanediamide
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| Structure |
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| Formula |
C29H30N4O2
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| Molecular Weight |
466.585
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| Canonical SMILES |
CCn1c2ccccc2c2cc(ccc12)N(C)C(=O)CC(C)CC(=O)N(C)c1ccc(cc1)C#N
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| InChI |
InChI=1S/C29H30N4O2/c1-5-33-26-9-7-6-8-24(26)25-18-23(14-15-27(25)33)32(4)29(35)17-20(2)16-28(34)31(3)22-12-10-21(19-30)11-13-22/h6-15,18,20H,5,16-17H2,1-4H3
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| InChIKey |
XGLPWVSUCGWJSP-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