In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2009 | 36 | 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) | 6.20 | 14.02 | -37.56 | 2 | 5 | 1 | 54 | 487.664 | 9 | ↓ |
Mid Mid (pH 6-8) | 6.20 | 11.46 | -10.06 | 1 | 5 | 0 | 53 | 486.656 | 9 | ↓ |