In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 31 | 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) | -3.25 | -0.8 | -362.78 | 3 | 16 | -4 | 261 | 503.169 | 8 | ↓ |
Mid Mid (pH 6-8) | -3.25 | -1.96 | -224.76 | 4 | 16 | -3 | 258 | 504.177 | 8 | ↓ |