In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 33 | 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) | 3.22 | 7.19 | -15.37 | 2 | 7 | 0 | 88 | 471.623 | 11 | ↓ |
Mid Mid (pH 6-8) | 3.22 | 9.24 | -53.43 | 3 | 7 | 1 | 89 | 472.631 | 11 | ↓ |