In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 10 | 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 | -0.5 | -33.28 | 4 | 3 | 1 | 51 | 145.226 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.93 | -0.2 | -119.01 | 5 | 3 | 2 | 52 | 146.234 | 2 | ↓ |