General Information of the Compound
| Compound ID |
CP0933241
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| Compound Name |
(E/Z)-N'-(6-bromo-2,3-dihydro-1H-inden-1-ylidene)-2-oxo-4-phenylpyrrolidine-3-carbohydrazide
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| Structure |
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| Formula |
C20H18BrN3O2
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| Molecular Weight |
412.287
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| Canonical SMILES |
O=C1NC[C@@H](c2ccccc2)[C@@H]1C(=O)N/N=C1\CCc2ccc(Br)cc21
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| InChI |
InChI=1S/C20H18BrN3O2/c21-14-8-6-13-7-9-17(15(13)10-14)23-24-20(26)18-16(11-22-19(18)25)12-4-2-1-3-5-12/h1-6,8,10,16,18H,7,9,11H2,(H,22,25)(H,24,26)/b23-17+/t16-,18-/m0/s1
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| InChIKey |
GPKOVIQXQLKOGM-JFIGCQMVSA-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