General Information of the Compound
| Compound ID |
CP0554981
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| Compound Name |
(1'R,5R)-1-(4-fluorophenyl)-1'-phenylspiro[4H-indazole-5,2'-cyclohexane]-1'-ol
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| Structure |
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| Formula |
C24H23FN2O
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| Molecular Weight |
374.459
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| Canonical SMILES |
O[C@@]1(CCCC[C@]11Cc2cnn(c2C=C1)-c1ccc(F)cc1)c1ccccc1
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| InChI |
InChI=1S/C24H23FN2O/c25-20-8-10-21(11-9-20)27-22-12-15-23(16-18(22)17-26-27)13-4-5-14-24(23,28)19-6-2-1-3-7-19/h1-3,6-12,15,17,28H,4-5,13-14,16H2/t23-,24-/m0/s1
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| InChIKey |
IDEHKJXWAPTFBV-ZEQRLZLVSA-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