General Information of the Compound
| Compound ID |
CP0515537
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| Compound Name |
[5-[(4-chlorophenyl)methyl]-2,4-dihydroxyphenyl]-(1,3-dihydroisoindol-2-yl)methanone
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| Structure |
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| Formula |
C22H18ClNO3
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| Molecular Weight |
379.843
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| Canonical SMILES |
Oc1cc(O)c(cc1Cc1ccc(Cl)cc1)C(=O)N1Cc2ccccc2C1
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| InChI |
InChI=1S/C22H18ClNO3/c23-18-7-5-14(6-8-18)9-17-10-19(21(26)11-20(17)25)22(27)24-12-15-3-1-2-4-16(15)13-24/h1-8,10-11,25-26H,9,12-13H2
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| InChIKey |
XVOFOGASNRBTAV-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