In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 37 | 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) | 3.91 | 11.53 | -20.88 | 0 | 7 | 0 | 62 | 511.638 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.91 | 13.83 | -56.58 | 1 | 7 | 1 | 64 | 512.646 | 9 | ↓ |