In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 12 | 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) | 0.93 | 5 | -7.42 | 0 | 2 | 0 | 30 | 161.204 | 1 | ↓ |
Lo Low (pH 4.5-6) | 0.93 | 5.44 | -40.23 | 1 | 2 | 1 | 31 | 162.212 | 1 | ↓ |