General Information of the Compound
| Compound ID |
CP0385832
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| Compound Name |
(2R)-1-(4-fluorophenoxy)-3-[4-(3-methoxyphenyl)piperazin-1-yl]propan-2-ol
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| Structure |
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| Formula |
C20H25FN2O3
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| Molecular Weight |
360.429
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| Canonical SMILES |
COc1cccc(c1)N1CCN(C[C@@H](O)COc2ccc(F)cc2)CC1
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| InChI |
InChI=1S/C20H25FN2O3/c1-25-20-4-2-3-17(13-20)23-11-9-22(10-12-23)14-18(24)15-26-19-7-5-16(21)6-8-19/h2-8,13,18,24H,9-12,14-15H2,1H3/t18-/m1/s1
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| InChIKey |
KZLPRWDZAHCVSA-GOSISDBHSA-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