General Information of the Compound
| Compound ID |
CP0831460
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| Compound Name |
7-bromo-2-(pyridin-2-yl)-4,5-dihydro-2H-benzo[e]indazol-1-ol
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| Formula |
C16H12BrN3O
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| Molecular Weight |
342.196
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| Canonical SMILES |
Oc1c2c(nn1-c1ccccn1)CCc1cc(Br)ccc1-2
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| InChI |
InChI=1S/C16H12BrN3O/c17-11-5-6-12-10(9-11)4-7-13-15(12)16(21)20(19-13)14-3-1-2-8-18-14/h1-3,5-6,8-9,21H,4,7H2
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| InChIKey |
LNONOGWBURYGPN-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