In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 18 | Yes |
Popular Name: 2-[(3-amino-2-pyridyl)sulfanyl]-6-propyl-1H-pyrimidin-4-one 2-[(3-amino-2-pyridyl)sulfanyl]-…
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) | 2.58 | 2.4 | -55.58 | 2 | 5 | -1 | 88 | 261.33 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.12 | 3.7 | -22.16 | 3 | 5 | 0 | 85 | 262.338 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.12 | 4.03 | -10.79 | 3 | 5 | 0 | 85 | 262.338 | 4 | ↓ |