In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 26 | Yes |
Popular Name: 2-[[4-allyl-5-(4-aminophenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(azepan-1-yl)ethanone 2-[[4-allyl-5-(4-aminophenyl)-1,…
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) | 2.98 | 9.82 | -13.02 | 2 | 6 | 0 | 77 | 371.51 | 6 | ↓ |