In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 20 | 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) | 3.03 | 5.37 | -13.72 | 1 | 4 | 0 | 63 | 289.356 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.03 | 5.52 | -49.35 | 0 | 4 | -1 | 65 | 288.348 | 4 | ↓ |