In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 23 | 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) | 0.98 | 6.44 | -67.95 | 2 | 6 | 1 | 76 | 317.365 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.98 | 5.06 | -22.33 | 1 | 6 | 0 | 72 | 316.357 | 3 | ↓ |