In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 14 | Yes |
Popular Name: 1-[(2-methyl-1H-imidazol-5-yl)sulfonyl]azetidin-3-amine 1-[(2-methyl-1H-imidazol-5-yl)su…
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) | -1.66 | -2.78 | -57.18 | 4 | 6 | 1 | 94 | 217.274 | 2 | ↓ |
Hi High (pH 8-9.5) | -1.66 | -3.09 | -13.22 | 3 | 6 | 0 | 92 | 216.266 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.