In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 17 | No |
Popular Name: 2-[2-[[(3R)-1,1-dioxothiolan-3-yl]amino]ethyl]pyridazin-3-one 2-[2-[[(3R)-1,1-dioxothiolan-3-y…
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) | -0.56 | 0.45 | -62.28 | 2 | 6 | 1 | 86 | 258.323 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.56 | -0.72 | -18.74 | 1 | 6 | 0 | 81 | 257.315 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.