In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 19 | 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) | 1.22 | 3.59 | -12.18 | 3 | 4 | 0 | 68 | 259.284 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.22 | 4.05 | -40.95 | 4 | 4 | 1 | 69 | 260.292 | 4 | ↓ |