In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 31st, 2010 | 26 | Yes |
Popular Name: 2-(1,2-benzoxazol-3-yl)-1-[4-(o-tolylmethyl)piperazin-1-yl]ethanone 2-(1,2-benzoxazol-3-yl)-1-[4-(o-…
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) | 3.19 | 8.99 | -17.49 | 0 | 5 | 0 | 50 | 349.434 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.19 | 10.86 | -57.72 | 1 | 5 | 1 | 51 | 350.442 | 4 | ↓ |