In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 16th, 2013 | 14 | 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) | 0.61 | 2.92 | -103 | 4 | 3 | 2 | 41 | 200.326 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.61 | 1.58 | -26.75 | 3 | 3 | 1 | 37 | 199.318 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.