In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 3rd, 2011 | 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) | -3.96 | -2.49 | -386.82 | 3 | 16 | -4 | 262 | 477.152 | 8 | ↓ |
Mid Mid (pH 6-8) | -3.96 | -3.65 | -247.67 | 4 | 16 | -3 | 259 | 478.16 | 8 | ↓ |