In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 22nd, 2011 | 23 | Yes |
Popular Name: 5-chloro-N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-1,3-dimethyl-pyrazole-4-sulfonamide 5-chloro-N-(4,7-dimethyl-1,3-ben…
None
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) | 4.39 | 5.76 | -12.52 | 1 | 6 | 0 | 80 | 370.887 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.46 | 5.42 | -47.64 | 0 | 6 | -1 | 79 | 369.879 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.