In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 30th, 2010 | 28 | 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) | 3.10 | 9.23 | -36.94 | 1 | 6 | 1 | 48 | 390.548 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.10 | 11.16 | -91.48 | 2 | 6 | 2 | 49 | 391.556 | 8 | ↓ |