In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2010 | 14 | Yes |
None
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) | 1.80 | 7.25 | -38.89 | 1 | 2 | 1 | 22 | 255.135 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.80 | 4.9 | -5.37 | 0 | 2 | 0 | 20 | 254.127 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.