In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 26 | 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) | 2.62 | 6.5 | -9.2 | 1 | 5 | 0 | 47 | 353.466 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.62 | 8.79 | -42.97 | 2 | 5 | 1 | 48 | 354.474 | 7 | ↓ |