In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 19 | Yes |
Popular Name: 7-[[(2R,6R)-2,6-dimethylpiperazin-1-yl]methyl]thiazolo[3,2-a]pyrimidin-5-one 7-[[(2R,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) | 0.79 | 4.13 | -89.91 | 3 | 5 | 2 | 55 | 280.397 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.79 | 3.73 | -46.63 | 2 | 5 | 1 | 54 | 279.389 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.