In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 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) | 2.18 | 8.52 | -51.01 | 1 | 5 | 1 | 67 | 237.279 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.18 | 6.46 | -14.05 | 0 | 5 | 0 | 66 | 236.271 | 6 | ↓ |