General Information of the Compound
| Compound ID |
CP0900101
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| Compound Name |
(E)-N'-(1-(3-bromophenyl)ethylidene)-N-methyl-2-oxo-4-phenylpyrrolidine-3-carbohydrazide
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| Structure |
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| Formula |
C20H20BrN3O2
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| Molecular Weight |
414.303
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| Canonical SMILES |
C/C(=N\N(C)C(=O)[C@@H]1C(=O)NC[C@H]1c1ccccc1)c1cccc(Br)c1
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| InChI |
InChI=1S/C20H20BrN3O2/c1-13(15-9-6-10-16(21)11-15)23-24(2)20(26)18-17(12-22-19(18)25)14-7-4-3-5-8-14/h3-11,17-18H,12H2,1-2H3,(H,22,25)/b23-13+/t17-,18-/m0/s1
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| InChIKey |
GAWDAEQJMOURHQ-SGASUCAWSA-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