In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 12th, 2010 | 11 | No |
None
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) | 0.03 | 6.26 | -59.89 | 1 | 4 | 0 | 59 | 152.153 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.03 | 5.81 | -58.02 | 0 | 4 | -1 | 58 | 151.145 | 2 | ↓ |