General Information of the Compound
| Compound ID |
CP0780847
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| Compound Name |
2-(6-fluorobenzo[d]thiazol-2-yl)-4,5-dihydro-2H-benzo[e]indazol-1-ol
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| Formula |
C18H12FN3OS
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| Molecular Weight |
337.379
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| Canonical SMILES |
Oc1c2c(nn1-c1nc3ccc(F)cc3s1)CCc1ccccc1-2
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| InChI |
InChI=1S/C18H12FN3OS/c19-11-6-8-13-15(9-11)24-18(20-13)22-17(23)16-12-4-2-1-3-10(12)5-7-14(16)21-22/h1-4,6,8-9,23H,5,7H2
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| InChIKey |
ZQJUJMXDLRLPPN-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