General Information of the Compound
| Compound ID |
CP0049626
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| Compound Name |
[4-(4-fluorophenyl)-5-(2-methylprop-1-enyl)-2,6-di(propan-2-yl)pyridin-3-yl]methanol
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| Structure |
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| Formula |
C22H28FNO
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| Molecular Weight |
341.47
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| Canonical SMILES |
CC(C)c1nc(C(C)C)c(C=C(C)C)c(-c2ccc(F)cc2)c1CO
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| InChI |
InChI=1S/C22H28FNO/c1-13(2)11-18-20(16-7-9-17(23)10-8-16)19(12-25)22(15(5)6)24-21(18)14(3)4/h7-11,14-15,25H,12H2,1-6H3
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| InChIKey |
GVBJJKSOKACDSI-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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