In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 14 | 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) | 0.30 | 3.67 | -84.97 | 4 | 4 | 2 | 50 | 203.33 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.30 | 2.29 | -40.71 | 3 | 4 | 1 | 46 | 202.322 | 8 | ↓ |