General Information of the Compound
| Compound ID |
CP0238066
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| Compound Name |
4-[2-amino-4-ethyl-5-(1-methylindazol-5-yl)pyridin-3-yl]phenol
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| Structure |
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| Formula |
C21H20N4O
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| Molecular Weight |
344.418
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| Canonical SMILES |
CCc1c(cnc(N)c1-c1ccc(O)cc1)-c1ccc2n(C)ncc2c1
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| InChI |
InChI=1S/C21H20N4O/c1-3-17-18(14-6-9-19-15(10-14)11-24-25(19)2)12-23-21(22)20(17)13-4-7-16(26)8-5-13/h4-12,26H,3H2,1-2H3,(H2,22,23)
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| InChIKey |
LYXWGAYLUFGHSW-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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