In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 18 | Yes |
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) | 0.92 | 6.66 | -39.23 | 2 | 5 | 1 | 54 | 251.354 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.92 | 4.44 | -7.66 | 1 | 5 | 0 | 52 | 250.346 | 5 | ↓ |