In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 30 | No |
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) | 3.08 | 9.94 | -76.99 | 4 | 6 | 2 | 90 | 440.956 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.08 | 9.47 | -39.01 | 3 | 6 | 1 | 89 | 439.948 | 7 | ↓ |