In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 21 | 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) | 3.05 | 5.13 | -7.88 | 0 | 4 | 0 | 39 | 289.375 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.05 | 7.44 | -39.69 | 1 | 4 | 1 | 40 | 290.383 | 4 | ↓ |