In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 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) | 3.75 | 3.53 | -6.98 | 2 | 4 | 0 | 61 | 246.31 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.75 | 3.43 | -27.05 | 3 | 4 | 1 | 63 | 247.318 | 3 | ↓ |