General Information of the Compound
| Compound ID |
CP0276473
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| Compound Name |
3,3,3-trifluoro-2-hydroxy-2-[(1-methyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)propanamide
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| Structure |
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| Formula |
C24H23F3N2O4
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| Molecular Weight |
460.452
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| Canonical SMILES |
Cc1noc(=O)c2ccc(NC(=O)C(O)(CC3(C)CCCc4ccccc34)C(F)(F)F)cc12
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| InChI |
InChI=1S/C24H23F3N2O4/c1-14-18-12-16(9-10-17(18)20(30)33-29-14)28-21(31)23(32,24(25,26)27)13-22(2)11-5-7-15-6-3-4-8-19(15)22/h3-4,6,8-10,12,32H,5,7,11,13H2,1-2H3,(H,28,31)
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| InChIKey |
BMVXBVREUULMTM-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