In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 32 | Yes |
Popular Name: N-[4-(4-allylpiperazin-1-yl)phenyl]-2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide N-[4-(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) | 3.57 | 7.87 | -46.69 | 2 | 7 | 1 | 76 | 450.588 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.57 | 5.63 | -12.59 | 1 | 7 | 0 | 74 | 449.58 | 9 | ↓ |