In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2006 | 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) | 1.33 | 1.77 | -9 | 1 | 4 | 0 | 59 | 226.301 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.33 | 2.05 | -41.91 | 2 | 4 | 1 | 60 | 227.309 | 3 | ↓ |