In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 21 | Yes |
Popular Name: 4-amino-2-bromo-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzenesulfonamide 4-amino-2-bromo-N-(4,5,6,7-tetra…
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) | 3.74 | 4.41 | -13.71 | 3 | 5 | 0 | 88 | 388.312 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.81 | 3.87 | -52.92 | 2 | 5 | -1 | 87 | 387.304 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.