General Information of the Compound
| Compound ID |
CP0148253
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| Compound Name |
2,2,4-Trimethyl-5-[1-phenyl-meth-(Z)-ylidene]-1,2,4,5-tetrahydro-6-oxa-1-aza-chrysen-3-one
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| Structure |
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| Formula |
C26H23NO2
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| Molecular Weight |
381.475
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| Canonical SMILES |
CC1C(=O)C(C)(C)Nc2ccc3-c4ccccc4O\C(=C/c4ccccc4)c3c12
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| InChI |
InChI=1S/C26H23NO2/c1-16-23-20(27-26(2,3)25(16)28)14-13-19-18-11-7-8-12-21(18)29-22(24(19)23)15-17-9-5-4-6-10-17/h4-16,27H,1-3H3/b22-15-
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| InChIKey |
OCLPHOSZZDWUFZ-JCMHNJIXSA-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