In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 10 | 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) | -1.64 | -0.12 | -55.61 | 3 | 4 | 1 | 65 | 143.166 | 1 | ↓ |
Mid Mid (pH 6-8) | -1.64 | -0.41 | -8.34 | 2 | 4 | 0 | 63 | 142.158 | 1 | ↓ |
Mid Mid (pH 6-8) | -1.64 | -0.42 | -7.03 | 2 | 4 | 0 | 63 | 142.158 | 1 | ↓ |