In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2006 | 25 | Yes |
Popular Name: 1-azepan-1-yl-2-[[5-methyl-4-(m-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propan-1-one 1-azepan-1-yl-2-[[5-methyl-4-(m-…
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) | 3.50 | 12.59 | -11.73 | 0 | 5 | 0 | 51 | 358.511 | 4 | ↓ |