In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 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) | 1.76 | 5.77 | -10.83 | 1 | 4 | 0 | 45 | 255.321 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.76 | 6.22 | -43.97 | 2 | 4 | 1 | 46 | 256.329 | 5 | ↓ |