In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 27th, 2008 | 15 | No |
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) | 0.54 | -0.79 | -15.48 | 2 | 5 | 0 | 61 | 213.281 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.54 | 1.4 | -50.95 | 3 | 5 | 1 | 63 | 214.289 | 4 | ↓ |