In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 16 | 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) | 3.29 | 4.52 | -5.74 | 2 | 3 | 0 | 52 | 216.284 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.29 | 4.77 | -26.73 | 3 | 3 | 1 | 53 | 217.292 | 3 | ↓ |