General Information of the Compound
| Compound ID |
CP0137965
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| Compound Name |
[1-(2-fluoro-5-hydroxybenzoyl)piperidin-4-yl]-(4-phenylsulfanylphenyl)methanone
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| Formula |
C25H22FNO3S
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| Molecular Weight |
435.52
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| Canonical SMILES |
Oc1ccc(F)c(c1)C(=O)N1CCC(CC1)C(=O)c1ccc(Sc2ccccc2)cc1
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| InChI |
InChI=1S/C25H22FNO3S/c26-23-11-8-19(28)16-22(23)25(30)27-14-12-18(13-15-27)24(29)17-6-9-21(10-7-17)31-20-4-2-1-3-5-20/h1-11,16,18,28H,12-15H2
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| InChIKey |
SYKQOVVZSRWKHB-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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