General Information of the Compound
| Compound ID |
CP0448533
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| Compound Name |
1-[6-fluorospiro[3,4-dihydro-2H-chromene-2,4'-(hexahydropyridine)]-1-yl]-4-phenyl-2-butanol
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| Structure |
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| Formula |
C23H28FNO2
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| Molecular Weight |
369.48
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| Canonical SMILES |
OC(CCc1ccccc1)CN1CCC2(CC1)CCc1cc(F)ccc1O2
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| InChI |
InChI=1S/C23H28FNO2/c24-20-7-9-22-19(16-20)10-11-23(27-22)12-14-25(15-13-23)17-21(26)8-6-18-4-2-1-3-5-18/h1-5,7,9,16,21,26H,6,8,10-15,17H2
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| InChIKey |
JPTJNKGXZCFAFQ-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
Protein ID: PT01492, 5-hydroxytryptamine receptor 2A
Protein ID: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C
Protein ID: PT01005, D(2) dopamine receptor