In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 3rd, 2006 | 24 | 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) | 2.79 | 6.94 | -44.16 | 2 | 6 | 1 | 65 | 349.48 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.79 | 4.36 | -14.95 | 1 | 6 | 0 | 63 | 348.472 | 6 | ↓ |