In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 16 | 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) | 4.12 | 7.15 | -5.51 | 2 | 2 | 0 | 39 | 252.77 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.12 | 7.57 | -29.3 | 3 | 2 | 1 | 40 | 253.778 | 3 | ↓ |