In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 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) | 2.78 | 6.9 | -12.58 | 1 | 3 | 0 | 38 | 238.29 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.78 | 7.32 | -28.3 | 2 | 3 | 1 | 39 | 239.298 | 2 | ↓ |