In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2006 | 9 | Yes |
Popular Name: 5-Chloro-2-methylpyrimidin-4(3H)-one 5-Chloro-2-methylpyrimidin-4(3H)…
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CAS Number: 26732-04-7
4-pyrimidinol, 5-chloro-2-methyl-
4-Pyrimidinol, 5-chloro-2-methyl- (7CI,8CI)
5-chloro-2-methyl-4-pyrimidinol
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.37 | 1.72 | -10.1 | 1 | 3 | 0 | 46 | 144.561 | 0 | ↓ |
Mid Mid (pH 6-8) | 0.83 | -0.31 | -40.21 | 0 | 3 | -1 | 49 | 143.553 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.