General Information of the Compound
| Compound ID |
CP0231706
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| Compound Name |
(R)-1-(1-cyclopropyl-2-methoxyethyl)-5-(6-(difluoromethoxy)-2,5-dimethylpyridin-3-ylamino)-3-methyl-1,2,4-triazin-6(1H)-one
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| Structure |
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| Formula |
C18H23F2N5O3
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| Molecular Weight |
395.41
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| Canonical SMILES |
COC[C@@H](C1CC1)n1nc(C)nc(Nc2cc(C)c(OC(F)F)nc2C)c1=O
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| InChI |
InChI=1S/C18H23F2N5O3/c1-9-7-13(10(2)21-16(9)28-18(19)20)23-15-17(26)25(24-11(3)22-15)14(8-27-4)12-5-6-12/h7,12,14,18H,5-6,8H2,1-4H3,(H,22,23,24)/t14-/m0/s1
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| InChIKey |
KYXNOTCRRUXNGE-AWEZNQCLSA-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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