In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 17 | 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) | 0.97 | 3.19 | -54.79 | 4 | 6 | 1 | 106 | 238.267 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.97 | 2.2 | -14.84 | 3 | 6 | 0 | 101 | 237.259 | 6 | ↓ |