In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 28th, 2008 | 18 | Yes |
Popular Name: 3-methyl-7-(1-piperidylmethyl)thiazolo[2,3-b]pyrimidin-5-one 3-methyl-7-(1-piperidylmethyl)th…
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) | 1.96 | 7.97 | -39.42 | 1 | 4 | 1 | 39 | 264.374 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.96 | 5.72 | -9.35 | 0 | 4 | 0 | 38 | 263.366 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.96 | 6.12 | -30.78 | 1 | 4 | 1 | 39 | 264.374 | 2 | ↓ |