In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2009 | 15 | 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) | 1.97 | 5.62 | -36.66 | 3 | 4 | 1 | 58 | 209.317 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.97 | 5.46 | -31.01 | 2 | 4 | 0 | 56 | 208.309 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.