| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 20th, 2008 | 15 | Yes |
Popular Name: 2-(3-chlorophenyl)-6-methylpyrimidin-4(3H)-one 2-(3-chlorophenyl)-6-methylpyrim…
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CAS Numbers: 180606-42-2 , [180606-42-2]
2-(3-Chloro-phenyl)-6-methyl-pyrimidin-4-ol
2-(3-chlorophenyl)-6-methyl-4(3H)-pyrimidinone
| 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) | 2.67 | 5.47 | -10.57 | 1 | 3 | 0 | 46 | 220.659 | 1 | ↓ |
| Hi High (pH 8-9.5) | 3.13 | 4.59 | -42.35 | 0 | 3 | -1 | 49 | 219.651 | 1 | ↓ |
