In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2008 | 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) | 3.15 | 5.08 | -5.35 | 3 | 3 | 0 | 55 | 242.109 | 1 | ↓ |
Lo Low (pH 4.5-6) | 3.16 | 5.15 | -33.57 | 4 | 3 | 1 | 56 | 243.117 | 1 | ↓ |