In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 14 | No |
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) | 0.14 | 5.99 | -20.32 | 0 | 4 | 0 | 51 | 195.218 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.88 | 4.86 | -56.21 | 0 | 4 | -1 | 57 | 194.21 | 3 | ↓ |