In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2011 | 19 | Yes |
Popular Name: N-[(5-chlorothiadiazol-4-yl)methyl]-2-(4-fluorophenoxy)-N-methyl-ethanamine N-[(5-chlorothiadiazol-4-yl)meth…
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) | 3.22 | 4.39 | -6.15 | 0 | 4 | 0 | 38 | 301.774 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.22 | 6.78 | -41.09 | 1 | 4 | 1 | 39 | 302.782 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.