In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 16 | No |
Popular Name: (2R)-2-[[[(3R)-1,1-dioxothiolan-3-yl]-methyl-amino]methyl]cyclopentanone (2R)-2-[[[(3R)-1,1-dioxothiolan-…
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) | 0.31 | 1.8 | -14.23 | 0 | 4 | 0 | 54 | 245.344 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.31 | 3.87 | -52.54 | 1 | 4 | 1 | 56 | 246.352 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.