In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2008 | 37 | 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) | 7.67 | 15.97 | -14.12 | 0 | 5 | 0 | 53 | 506.627 | 7 | ↓ |
Lo Low (pH 4.5-6) | 7.67 | 16.38 | -33.99 | 1 | 5 | 1 | 54 | 507.635 | 7 | ↓ |