General Information of the Compound
| Compound ID |
CP0472487
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| Compound Name |
(s)-2-(4-oxobenzo[d][1,2,3]triazin-3 (4h)-yl)-n-(1-(4-(trifluoromethyl)phenyl)propyl)acetamide
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| Structure |
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| Formula |
C19H17F3N4O2
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| Molecular Weight |
390.365
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| Canonical SMILES |
CC[C@H](NC(=O)Cn1nnc2ccccc2c1=O)c1ccc(cc1)C(F)(F)F
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| InChI |
InChI=1S/C19H17F3N4O2/c1-2-15(12-7-9-13(10-8-12)19(20,21)22)23-17(27)11-26-18(28)14-5-3-4-6-16(14)24-25-26/h3-10,15H,2,11H2,1H3,(H,23,27)/t15-/m0/s1
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| InChIKey |
IXZCMRONQCIGHM-HNNXBMFYSA-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