In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 18 | 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) | 2.53 | 6.28 | -52.88 | 2 | 4 | -1 | 79 | 261.326 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.53 | 6.67 | -60.01 | 3 | 4 | 0 | 80 | 262.334 | 4 | ↓ |