General Information of the Compound
| Compound ID |
CP0439810
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| Compound Name |
N-(2,4-dimethoxyphenyl)-N-[2-[1-(dimethylamino)propan-2-ylamino]-1-(2-fluorophenyl)-2-oxoethyl]benzamide
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| Structure |
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| Formula |
C28H32FN3O4
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| Molecular Weight |
493.579
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| Canonical SMILES |
COc1ccc(N(C(C(=O)NC(C)CN(C)C)c2ccccc2F)C(=O)c2ccccc2)c(OC)c1
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| InChI |
InChI=1S/C28H32FN3O4/c1-19(18-31(2)3)30-27(33)26(22-13-9-10-14-23(22)29)32(28(34)20-11-7-6-8-12-20)24-16-15-21(35-4)17-25(24)36-5/h6-17,19,26H,18H2,1-5H3,(H,30,33)
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| InChIKey |
MZAHUXATQGDNPE-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