In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2009 | 39 | 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) | 4.15 | 15.25 | -63.18 | 1 | 8 | 0 | 91 | 524.621 | 10 | ↓ |
Lo Low (pH 4.5-6) | 4.15 | 14.12 | -55.75 | 2 | 8 | 1 | 89 | 525.629 | 10 | ↓ |