In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 17 | No |
Popular Name: 2-[[(3S)-1,1-dioxothiolan-3-yl]-methyl-amino]thiazole-5-carboxylic 2-[[(3S)-1,1-dioxothiolan-3-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) | 0.42 | 2.84 | -57.67 | 0 | 6 | -1 | 90 | 275.331 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.42 | 3.23 | -52.86 | 1 | 6 | 0 | 92 | 276.339 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.