In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2010 | 16 | 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) | 2.89 | 7.39 | -54.71 | 0 | 3 | -1 | 49 | 221.276 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.89 | 5.16 | -6.33 | 1 | 3 | 0 | 47 | 222.284 | 5 | ↓ |