General Information of the Compound
| Compound ID |
CP0739550
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| Compound Name |
7-methoxy-2-(pyridin-2-yl)-4,5-dihydro-2H-benzo[e]indazol-1-ol
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| Formula |
C17H15N3O2
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| Molecular Weight |
293.326
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| Canonical SMILES |
COc1ccc2c(c1)CCc1nn(-c3ccccn3)c(O)c1-2
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| InChI |
InChI=1S/C17H15N3O2/c1-22-12-6-7-13-11(10-12)5-8-14-16(13)17(21)20(19-14)15-4-2-3-9-18-15/h2-4,6-7,9-10,21H,5,8H2,1H3
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| InChIKey |
HEZMRDOGJVRBQC-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