In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 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) | 0.89 | 0.33 | -4.85 | 0 | 3 | 0 | 25 | 171.24 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.89 | 2.52 | -34.92 | 1 | 3 | 1 | 26 | 172.248 | 3 | ↓ |