In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2010 | 15 | 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) | 2.40 | 4.57 | -6.36 | 1 | 2 | 0 | 33 | 199.253 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.40 | 4.53 | -26.98 | 2 | 2 | 1 | 34 | 200.261 | 2 | ↓ |