In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 37 | 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) | 5.50 | 14.96 | -52.87 | 2 | 5 | 1 | 50 | 523.501 | 7 | ↓ |
Lo Low (pH 4.5-6) | 5.50 | 15.28 | -111.07 | 3 | 5 | 2 | 51 | 524.509 | 7 | ↓ |