In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 14th, 2011 | 21 | Yes |
Popular Name: 4-[(4-ethyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-fluorophenyl)butan-1-one 4-[(4-ethyl-5-methyl-1,2,4-triaz…
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) | 2.69 | 10.78 | -14.25 | 0 | 4 | 0 | 48 | 307.394 | 7 | ↓ |