In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2006 | 28 | Yes |
Popular Name: N-[2-(4-allylpiperazin-1-yl)phenyl]-2-[(5-isopropyl-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) | 2.60 | 6.15 | -45.99 | 2 | 7 | 1 | 76 | 402.544 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.60 | 3.99 | -9.13 | 1 | 7 | 0 | 74 | 401.536 | 8 | ↓ |