In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 24 | Yes |
Popular Name: (2S)-2-[(6-methyl-5-oxo-4H-1,2,4-triazin-3-yl)sulfanyl]-N-(1-naphthyl)propanamide (2S)-2-[(6-methyl-5-oxo-4H-1,2,4…
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) | 2.61 | 6.18 | -12.68 | 2 | 6 | 0 | 88 | 340.408 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.07 | 4.44 | -45.5 | 1 | 6 | -1 | 91 | 339.4 | 4 | ↓ |