General Information of the Compound
| Compound ID |
CP0894422
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| Compound Name |
(E)-N'-(1-(3-Bromophenyl)ethylidene)-1-(2-methylprop-1-enyl)-2-oxo-4-phenylpyrrolidine-3-carbohydrazide
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| Structure |
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| Formula |
C23H24BrN3O2
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| Molecular Weight |
454.368
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| Canonical SMILES |
CC(C)=CN1C[C@@H](c2ccccc2)[C@H](C(=O)N/N=C(\C)c2cccc(Br)c2)C1=O
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| InChI |
InChI=1S/C23H24BrN3O2/c1-15(2)13-27-14-20(17-8-5-4-6-9-17)21(23(27)29)22(28)26-25-16(3)18-10-7-11-19(24)12-18/h4-13,20-21H,14H2,1-3H3,(H,26,28)/b25-16+/t20-,21+/m0/s1
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| InChIKey |
GWPZAGFGUDBXOK-JLCFHOEASA-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