In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 4th, 2007 | 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) | 1.40 | 4.23 | -66.8 | 0 | 9 | -1 | 104 | 486.57 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.40 | 6.5 | -83.51 | 1 | 9 | 0 | 105 | 487.578 | 8 | ↓ |