In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 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) | 0.81 | 3.7 | -11.18 | 1 | 4 | 0 | 55 | 219.269 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.81 | 3.99 | -40.83 | 2 | 4 | 1 | 56 | 220.277 | 2 | ↓ |