In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 20 | Yes |
Popular Name: N-[(5-chlorothiadiazol-4-yl)methyl]-1-[4-(difluoromethoxy)phenyl]-N-methyl-methanamine 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) | 3.39 | 6.53 | -41.49 | 1 | 4 | 1 | 39 | 320.772 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.39 | 4.2 | -7.39 | 0 | 4 | 0 | 38 | 319.764 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.