In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 25th, 2009 | 30 | 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) | 6.49 | 13.85 | -27.79 | 1 | 3 | 1 | 23 | 392.478 | 2 | ↓ |
Mid Mid (pH 6-8) | 6.49 | 11.6 | -8.89 | 0 | 3 | 0 | 22 | 391.47 | 2 | ↓ |