In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 1st, 2009 | 27 | 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) | 2.73 | 5.52 | -61.9 | 0 | 7 | -1 | 90 | 383.405 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.28 | 7.51 | -17.35 | 1 | 7 | 0 | 86 | 384.413 | 5 | ↓ |