In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 3rd, 2009 | 15 | 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) | 1.70 | 2.9 | -41.44 | 3 | 3 | 1 | 46 | 230.715 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.70 | 1.41 | -8.43 | 2 | 3 | 0 | 41 | 229.707 | 7 | ↓ |