In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 16 | 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) | 2.70 | 2.87 | -43.91 | 0 | 4 | -1 | 57 | 307.189 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.70 | 2.81 | -9.25 | 1 | 4 | 0 | 55 | 308.197 | 4 | ↓ |