In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 21 | No |
Popular Name: 2-[(6-amino-3-pyridyl)sulfanyl]-N-(2,1,3-benzothiadiazol-4-yl)acetamide 2-[(6-amino-3-pyridyl)sulfanyl]-…
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) | 1.98 | 2.79 | -10.91 | 3 | 6 | 0 | 94 | 317.399 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.98 | 3.28 | -38.27 | 4 | 6 | 1 | 95 | 318.407 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.