In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2008 | 19 | 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) | 0.25 | -3.34 | -7.63 | 1 | 7 | 0 | 76 | 263.301 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.25 | -3.09 | -33.34 | 2 | 7 | 1 | 77 | 264.309 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.