In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2010 | 31 | 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) | 1.31 | 1.96 | -18.66 | 4 | 10 | 0 | 138 | 422.445 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.31 | 2.4 | -41.89 | 5 | 10 | 1 | 140 | 423.453 | 6 | ↓ |