In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 18 | Yes |
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) | 3.39 | 9.32 | -6.84 | 0 | 2 | 0 | 26 | 240.35 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.39 | 9.78 | -34.97 | 1 | 2 | 1 | 27 | 241.358 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.39 | 10.24 | -70.49 | 2 | 2 | 2 | 28 | 242.366 | 7 | ↓ |