In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2010 | 25 | Yes |
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) | 0.54 | 6.99 | -48.79 | 2 | 6 | 1 | 67 | 343.451 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.54 | 7.4 | -84.43 | 3 | 6 | 2 | 68 | 344.459 | 4 | ↓ |