General Information of the Compound
| Compound ID |
CP0421856
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| Compound Name |
(5S)-1-(4-fluorophenyl)-1'-phenylspiro[4H-indazole-5,6'-cyclohexene]
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| Structure |
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| Formula |
C24H21FN2
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| Molecular Weight |
356.444
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| Canonical SMILES |
Fc1ccc(cc1)-n1ncc2C[C@@]3(CCCC=C3c3ccccc3)C=Cc12
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| InChI |
InChI=1S/C24H21FN2/c25-20-9-11-21(12-10-20)27-23-13-15-24(16-19(23)17-26-27)14-5-4-8-22(24)18-6-2-1-3-7-18/h1-3,6-13,15,17H,4-5,14,16H2/t24-/m1/s1
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| InChIKey |
BMXRHVHPOUJMAM-XMMPIXPASA-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
Protein ID: PT00967, Glucocorticoid receptor
Protein ID: PT01172, Progesterone receptor