In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 13th, 2009 | 32 | 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) | 4.60 | 8.05 | -47.43 | 2 | 7 | 1 | 76 | 471.006 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.60 | 5.81 | -13.99 | 1 | 7 | 0 | 74 | 469.998 | 8 | ↓ |