In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 1st, 2010 | 27 | 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) | 1.71 | 6.76 | -86.78 | 3 | 8 | 2 | 76 | 394.545 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.71 | 9.21 | -103.69 | 3 | 8 | 2 | 76 | 394.545 | 7 | ↓ |