In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2010 | 23 | 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) | 3.02 | 9.26 | -8.87 | 0 | 3 | 0 | 24 | 308.425 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.02 | 11.14 | -45.37 | 1 | 3 | 1 | 25 | 309.433 | 3 | ↓ |