In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2009 | 24 | 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) | 3.14 | 7.02 | -17.01 | 1 | 5 | 0 | 60 | 322.364 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.14 | 7.42 | -47.18 | 2 | 5 | 1 | 62 | 323.372 | 4 | ↓ |