In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 21st, 2009 | 21 | 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) | -3.02 | -0.92 | -84.1 | 5 | 8 | 0 | 137 | 301.343 | 6 | ↓ |
Mid Mid (pH 6-8) | -3.02 | -1.56 | -56.85 | 4 | 8 | -1 | 136 | 300.335 | 6 | ↓ |