In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 12th, 2011 | 37 | 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) | 4.01 | 11.48 | -50.97 | 4 | 8 | 1 | 101 | 527.02 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.01 | 9.24 | -11.78 | 3 | 8 | 0 | 100 | 526.012 | 9 | ↓ |