In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 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) | 1.85 | 3.62 | -55.98 | 4 | 5 | 1 | 75 | 273.312 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.85 | 3.23 | -15.72 | 3 | 5 | 0 | 74 | 272.304 | 5 | ↓ |