In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 23rd, 2008 | 23 | No |
Popular Name: N-(2,1,3-benzothiadiazol-5-yl)-N'-(3-imidazol-1-ylpropyl)oxamide N-(2,1,3-benzothiadiazol-5-yl)-N…
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) | 0.25 | 3.28 | -13.46 | 2 | 8 | 0 | 102 | 330.373 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.25 | 3.8 | -41.26 | 3 | 8 | 1 | 103 | 331.381 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.