In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 2010 | 28 | 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) | 1.58 | 4.81 | -53.79 | 1 | 9 | -1 | 134 | 381.32 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.58 | 4.05 | -18.39 | 2 | 9 | 0 | 131 | 382.328 | 4 | ↓ |