General Information of the Compound
| Compound ID |
CP0516099
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| Compound Name |
5'-(3-nitrophenyl)spiro[cyclopentane-1,3'-indol]-2'(1'H)-one
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| Structure |
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| Formula |
C18H16N2O3
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| Molecular Weight |
308.337
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| Canonical SMILES |
[O-][N+](=O)c1cccc(c1)-c1ccc2NC(=O)C3(CCCC3)c2c1
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| InChI |
InChI=1S/C18H16N2O3/c21-17-18(8-1-2-9-18)15-11-13(6-7-16(15)19-17)12-4-3-5-14(10-12)20(22)23/h3-7,10-11H,1-2,8-9H2,(H,19,21)
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| InChIKey |
AWTOGSZGTICREU-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