General Information of the Compound
| Compound ID |
CP0472919
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| Compound Name |
6'-fluoro-1'-[[1-(4-hydroxybutyl)benzimidazol-2-yl]methyl]spiro[cyclopropane-1,3'-indole]-2'-one
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| Structure |
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| Formula |
C22H22FN3O2
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| Molecular Weight |
379.435
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| Canonical SMILES |
OCCCCn1c(CN2C(=O)C3(CC3)c3ccc(F)cc23)nc2ccccc12
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| InChI |
InChI=1S/C22H22FN3O2/c23-15-7-8-16-19(13-15)26(21(28)22(16)9-10-22)14-20-24-17-5-1-2-6-18(17)25(20)11-3-4-12-27/h1-2,5-8,13,27H,3-4,9-12,14H2
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| InChIKey |
NGCJRMATWQLHLB-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