General Information of the Compound
| Compound ID |
CP0476260
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| Compound Name |
(1'S,5S)-1-(4-fluorophenyl)-1'-phenylspiro[4H-indazole-5,2'-cyclopentane]-1'-ol
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| Structure |
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| Formula |
C23H21FN2O
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| Molecular Weight |
360.432
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| Canonical SMILES |
O[C@]1(CCC[C@@]11Cc2cnn(c2C=C1)-c1ccc(F)cc1)c1ccccc1
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| InChI |
InChI=1S/C23H21FN2O/c24-19-7-9-20(10-8-19)26-21-11-14-22(15-17(21)16-25-26)12-4-13-23(22,27)18-5-2-1-3-6-18/h1-3,5-11,14,16,27H,4,12-13,15H2/t22-,23-/m1/s1
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| InChIKey |
RUTMZHDXFAFHMG-DHIUTWEWSA-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