In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 15 | 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) | 2.04 | 3.47 | -5.83 | 0 | 3 | 0 | 30 | 245.731 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.04 | 5.67 | -38.9 | 1 | 3 | 1 | 31 | 246.739 | 3 | ↓ |