In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2006 | 28 | Yes |
Popular Name: 2-[(4-benzyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3,4-dimethylphenyl)-propan-1-one 2-[(4-benzyl-5-cyclopropyl-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) | 4.76 | 2.69 | -11.54 | 0 | 4 | 0 | 47 | 391.54 | 7 | ↓ |