General Information of the Compound
| Compound ID |
CP0565065
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| Compound Name |
6-[(2R)-5-chloro-2-(2-hydroxyethyl)-2,3-dihydroindole-1-carbonyl]-4H-1,4-benzoxazin-3-one
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| Structure |
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| Formula |
C19H17ClN2O4
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| Molecular Weight |
372.808
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| Canonical SMILES |
OCC[C@H]1Cc2cc(Cl)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1
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| InChI |
InChI=1S/C19H17ClN2O4/c20-13-2-3-16-12(7-13)8-14(5-6-23)22(16)19(25)11-1-4-17-15(9-11)21-18(24)10-26-17/h1-4,7,9,14,23H,5-6,8,10H2,(H,21,24)/t14-/m0/s1
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| InChIKey |
RNFNFRANQNBNSW-AWEZNQCLSA-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