In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2009 | 18 | No |
Popular Name: 5-amino-N-(1,1-dioxothian-4-yl)-3-methyl-1H-pyrazole-4-carboxamide 5-amino-N-(1,1-dioxothian-4-yl)-…
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) | -0.94 | -1.82 | -18.23 | 4 | 7 | 0 | 118 | 272.33 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.94 | -1.69 | -46.28 | 5 | 7 | 1 | 119 | 273.338 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.