In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2009 | 23 | 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) | 3.65 | 7.3 | -55.91 | 0 | 4 | -1 | 53 | 310.373 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.65 | 9.65 | -73.55 | 1 | 4 | 0 | 54 | 311.381 | 4 | ↓ |