In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 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) | 1.46 | 5.89 | -32.28 | 3 | 2 | 1 | 30 | 191.298 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.46 | 3.62 | -4.27 | 2 | 2 | 0 | 29 | 190.29 | 1 | ↓ |