General Information of the Compound
| Compound ID |
CP0421084
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| Compound Name |
5-fluoro-3-(2'-oxo-1',2'-dihydrospiro[cyclopentane-1,3'-indol]-5'-yl)benzonitrile
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| Structure |
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| Formula |
C19H15FN2O
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| Molecular Weight |
306.34
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| Canonical SMILES |
Fc1cc(cc(c1)-c1ccc2NC(=O)C3(CCCC3)c2c1)C#N
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| InChI |
InChI=1S/C19H15FN2O/c20-15-8-12(11-21)7-14(9-15)13-3-4-17-16(10-13)19(18(23)22-17)5-1-2-6-19/h3-4,7-10H,1-2,5-6H2,(H,22,23)
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| InChIKey |
SIVWNWQUUDHRMU-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