In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 19 | Yes |
Popular Name: 5-methyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1H-pyrazole-4-sulfonamide 5-methyl-N-(4,5,6,7-tetrahydro-1…
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) | 2.46 | 2.79 | -12.95 | 2 | 6 | 0 | 91 | 298.393 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.53 | 2.27 | -47.82 | 1 | 6 | -1 | 90 | 297.385 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.