General Information of the Compound
| Compound ID |
CP0372653
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| Compound Name |
9-(3,5-dimethylphenyl)-2-hydroxy-6,11-dihydro-5H-benzo[a]carbazole-3-carboxylic acid
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| Structure |
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| Formula |
C25H21NO3
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| Molecular Weight |
383.447
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| Canonical SMILES |
Cc1cc(C)cc(c1)-c1ccc2c3CCc4cc(C(O)=O)c(O)cc4-c3[nH]c2c1
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| InChI |
InChI=1S/C25H21NO3/c1-13-7-14(2)9-17(8-13)15-3-5-18-19-6-4-16-10-21(25(28)29)23(27)12-20(16)24(19)26-22(18)11-15/h3,5,7-12,26-27H,4,6H2,1-2H3,(H,28,29)
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| InChIKey |
BIVCSCVSPSZJON-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