General Information of the Compound
| Compound ID |
CP0531237
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| Compound Name |
4-[[1-[[4-(diethylaminomethyl)phenyl]methyl]-2-oxo-4-phenylquinolin-3-yl]oxymethyl]-N-hydroxybenzamide
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| Formula |
C35H35N3O4
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| Molecular Weight |
561.682
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| Canonical SMILES |
CCN(CC)Cc1ccc(Cn2c3ccccc3c(-c3ccccc3)c(OCc3ccc(cc3)C(=O)NO)c2=O)cc1
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| InChI |
InChI=1S/C35H35N3O4/c1-3-37(4-2)22-25-14-16-26(17-15-25)23-38-31-13-9-8-12-30(31)32(28-10-6-5-7-11-28)33(35(38)40)42-24-27-18-20-29(21-19-27)34(39)36-41/h5-21,41H,3-4,22-24H2,1-2H3,(H,36,39)
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| InChIKey |
DDBRHLGFUOFBFM-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