General Information of the Compound
| Compound ID |
CP0688886
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| Compound Name |
5-Chloro-3-(2-oxopropylidene)indole-2-one
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| Structure |
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| Formula |
C11H8ClNO2
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| Molecular Weight |
221.643
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| Canonical SMILES |
CC(=O)/C=C1\C(=O)Nc2ccc(Cl)cc21
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| InChI |
InChI=1S/C11H8ClNO2/c1-6(14)4-9-8-5-7(12)2-3-10(8)13-11(9)15/h2-5H,1H3,(H,13,15)/b9-4-
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| InChIKey |
NGBDRYCUEWUGNM-WTKPLQERSA-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