In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 12th, 2009 | 36 | 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) | 4.93 | 11.65 | -40.4 | 0 | 7 | -1 | 86 | 502.547 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.93 | 10.51 | -20.85 | 1 | 7 | 0 | 83 | 503.555 | 6 | ↓ |