In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2011 | 16 | No |
Popular Name: (4R)-4-[(2R,6R)-2,6-dimethylpiperazine-1-carbonyl]thiazolidin-2-one (4R)-4-[(2R,6R)-2,6-dimethylpipe…
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) | -0.36 | 0.99 | -61.54 | 3 | 5 | 1 | 66 | 244.34 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.36 | -0.35 | -12.37 | 2 | 5 | 0 | 61 | 243.332 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.