In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 17 | 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) | 2.71 | 2.16 | -4.63 | 4 | 3 | 0 | 58 | 238.306 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.71 | 2.03 | -42.65 | 5 | 3 | 1 | 60 | 239.314 | 3 | ↓ |