In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 10th, 2010 | 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) | -0.02 | 3.21 | -62.07 | 2 | 4 | 1 | 54 | 191.21 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.02 | 1.81 | -12.72 | 1 | 4 | 0 | 49 | 190.202 | 1 | ↓ |