In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2010 | 29 | 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) | 1.54 | 1.21 | -162.63 | 4 | 11 | -2 | 183 | 433.398 | 11 | ↓ |
Mid Mid (pH 6-8) | 1.54 | 0.05 | -66.15 | 5 | 11 | -1 | 180 | 434.406 | 11 | ↓ |