In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 17 | Yes |
Popular Name: 6-Methyl-2-methylsulfanyl-5-piperidin-1-ylmethyl-pyrimidin-4-ol 6-Methyl-2-methylsulfanyl-5-pipe…
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) | 2.01 | 5.88 | -31.92 | 2 | 4 | 1 | 50 | 254.379 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.47 | 1.82 | -46.72 | 0 | 4 | -1 | 52 | 252.363 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.01 | 6.34 | -88.84 | 3 | 4 | 2 | 51 | 255.387 | 3 | ↓ |