In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 18 | 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) | 2.53 | 7.82 | -37.66 | 2 | 2 | 1 | 16 | 243.374 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.53 | 8.85 | -115.72 | 3 | 2 | 2 | 21 | 244.382 | 2 | ↓ |