In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2010 | 18 | 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) | 4.27 | 6.26 | -5.76 | 2 | 3 | 0 | 52 | 244.338 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.27 | 6.2 | -27.64 | 3 | 3 | 1 | 53 | 245.346 | 4 | ↓ |