In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 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) | 0.59 | 3.81 | -5.96 | 2 | 3 | 0 | 52 | 191.296 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.59 | 4.15 | -45.76 | 3 | 3 | 1 | 54 | 192.304 | 7 | ↓ |