General Information of the Compound
| Compound ID |
CP0550810
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| Compound Name |
N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide
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| Formula |
C19H20N4O3
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| Molecular Weight |
352.394
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| Canonical SMILES |
COc1ccc(cc1)[C@H](C)NC(=O)C(C)n1nnc2ccccc2c1=O
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| InChI |
InChI=1S/C19H20N4O3/c1-12(14-8-10-15(26-3)11-9-14)20-18(24)13(2)23-19(25)16-6-4-5-7-17(16)21-22-23/h4-13H,1-3H3,(H,20,24)/t12-,13?/m0/s1
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| InChIKey |
CXUQELLPPYXOBQ-UEWDXFNNSA-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