In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 26th, 2007 | 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) | 0.97 | 0.29 | -40.6 | 1 | 5 | -1 | 78 | 228.231 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.52 | 2.13 | -8.06 | 2 | 5 | 0 | 75 | 229.239 | 3 | ↓ |