In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 2009 | 12 | 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) | -0.85 | 2.37 | -39.29 | 4 | 4 | 1 | 60 | 172.252 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.85 | 0.14 | -10.95 | 3 | 4 | 0 | 58 | 171.244 | 2 | ↓ |