In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 34 | 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) | 4.84 | 8.6 | -53.16 | 2 | 7 | -1 | 106 | 492.964 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.84 | 9.24 | -18.88 | 3 | 7 | 0 | 104 | 493.972 | 8 | ↓ |