In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 21 | 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) | 0.44 | 5.14 | -45.35 | 1 | 9 | -1 | 134 | 297.243 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.44 | 3.16 | -10.34 | 2 | 9 | 0 | 131 | 298.251 | 7 | ↓ |