In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2009 | 14 | 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) | 2.76 | 5.93 | -7.38 | 1 | 2 | 0 | 36 | 188.274 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.76 | 7.05 | -51.02 | 2 | 2 | 1 | 40 | 189.282 | 4 | ↓ |