In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 15 | 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) | 0.28 | 6.85 | -48.99 | 1 | 4 | 1 | 49 | 212.317 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.28 | 4.81 | -11.2 | 0 | 4 | 0 | 47 | 211.309 | 7 | ↓ |