In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 3rd, 2011 | 19 | No |
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) | 2.26 | 7.31 | -12.93 | 0 | 6 | 0 | 77 | 254.249 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.26 | 7.77 | -50.2 | 1 | 6 | 1 | 78 | 255.257 | 2 | ↓ |