In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2010 | 20 | 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) | 1.64 | 5.24 | -9.25 | 1 | 4 | 0 | 51 | 274.295 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.64 | 5.69 | -42.49 | 2 | 4 | 1 | 52 | 275.303 | 6 | ↓ |