In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 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) | 1.96 | 3.37 | -25.84 | 5 | 4 | 1 | 64 | 195.29 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.96 | 2.9 | -5.25 | 4 | 4 | 0 | 63 | 194.282 | 5 | ↓ |