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) | 0.52 | 1.66 | -47.53 | 4 | 4 | 1 | 64 | 210.301 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.52 | 2.21 | -96.56 | 5 | 4 | 2 | 65 | 211.309 | 6 | ↓ |