In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 16 | 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) | 1.38 | 3.53 | -45.5 | 4 | 4 | 1 | 60 | 287.181 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.38 | 1 | -9.99 | 3 | 4 | 0 | 58 | 286.173 | 4 | ↓ |