In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 14th, 2010 | 18 | Yes |
Popular Name: 7-[(4-hydroxy-1-piperidyl)methyl]thiazolo[3,2-a]pyrimidin-5-one 7-[(4-hydroxy-1-piperidyl)methyl…
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) | -0.14 | 2.31 | -34.9 | 2 | 5 | 1 | 59 | 266.346 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.14 | 4.62 | -45.18 | 2 | 5 | 1 | 59 | 266.346 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.14 | 2.34 | -12.45 | 1 | 5 | 0 | 58 | 265.338 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.