General Information of the Compound
| Compound ID |
CP0426004
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| Compound Name |
N-(cyclobutylmethyl)-N-[2-(3,5-difluoroanilino)-2-oxoethyl]-4-pyridin-2-ylbenzamide
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| Structure |
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| Formula |
C25H23F2N3O2
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| Molecular Weight |
435.474
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| Canonical SMILES |
Fc1cc(F)cc(NC(=O)CN(CC2CCC2)C(=O)c2ccc(cc2)-c2ccccn2)c1
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| InChI |
InChI=1S/C25H23F2N3O2/c26-20-12-21(27)14-22(13-20)29-24(31)16-30(15-17-4-3-5-17)25(32)19-9-7-18(8-10-19)23-6-1-2-11-28-23/h1-2,6-14,17H,3-5,15-16H2,(H,29,31)
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| InChIKey |
IRZFZRJGCRCJCH-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