In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2009 | 32 | Yes |
Popular Name: N-[2-(4-allylpiperazin-1-yl)phenyl]-2-[[5-(o-tolyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide N-[2-(4-allylpiperazin-1-yl)phen…
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) | 4.32 | 9.09 | -46.51 | 2 | 7 | 1 | 76 | 450.588 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.32 | 6.93 | -9.77 | 1 | 7 | 0 | 74 | 449.58 | 8 | ↓ |