In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2010 | 20 | Yes |
Popular Name: 6-tert-butyl-N-[(5-chloro-2-thienyl)methyl]imidazo[2,1-b][1,3,4]thiadiazol-2-amine 6-tert-butyl-N-[(5-chloro-2-thie…
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) | 4.72 | 8.79 | -9.3 | 1 | 4 | 0 | 42 | 326.878 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.72 | 9.12 | -25.45 | 2 | 4 | 1 | 43 | 327.886 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.