In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 20 | Yes |
Popular Name: 7-[[(2S,6R)-2,6-dimethylpiperazin-1-yl]methyl]-3-methyl-thiazolo[3,2-a]pyrimidin-5-one 7-[[(2S,6R)-2,6-dimethylpiperazi…
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) | 1.01 | 4.76 | -92.68 | 3 | 5 | 2 | 55 | 294.424 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.01 | 4.48 | -43.28 | 2 | 5 | 1 | 54 | 293.416 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.