General Information of the Compound
| Compound ID |
CP0524959
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| Compound Name |
3-(1H-indol-5-yl)cyclohex-2-enone
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| Structure |
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| Formula |
C14H13NO
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| Molecular Weight |
211.264
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| Canonical SMILES |
O=C1CCCC(=C1)c1ccc2[nH]ccc2c1
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| InChI |
InChI=1S/C14H13NO/c16-13-3-1-2-10(9-13)11-4-5-14-12(8-11)6-7-15-14/h4-9,15H,1-3H2
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| InChIKey |
LPSDOXKSOKFOEH-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
Protein ID: PT03954, Calmodulin-sensitive adenylate cyclase
Protein ID: PT06109, Geminin