In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 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) | -0.01 | 2.61 | -50.45 | 3 | 3 | 1 | 46 | 194.254 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.01 | 2.28 | -6.55 | 2 | 3 | 0 | 44 | 193.246 | 3 | ↓ |