In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 33 | 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) | 1.50 | 1.05 | -40.51 | 3 | 11 | -1 | 160 | 458.495 | 9 | ↓ |
Lo Low (pH 4.5-6) | 1.50 | 1.5 | -54.78 | 4 | 11 | 0 | 162 | 459.503 | 9 | ↓ |