In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 20 | 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) | 1.84 | 3.24 | -7.94 | 3 | 4 | 0 | 64 | 270.332 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.84 | 4.38 | -39.31 | 4 | 4 | 1 | 69 | 271.34 | 6 | ↓ |