In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2010 | 19 | 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) | -0.49 | -2.28 | -7.53 | 3 | 6 | 0 | 85 | 283.353 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.49 | 0.08 | -39.45 | 4 | 6 | 1 | 86 | 284.361 | 5 | ↓ |