In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 28th, 2008 | 25 | Yes |
Popular Name: 7-[[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]methyl]thiazolo[2,3-b]pyrimidin-5-one 7-[[4-(2-oxo-2-pyrrolidin-1-yl-e…
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) | 0.48 | 4.74 | -39.28 | 1 | 7 | 1 | 62 | 362.479 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.48 | 4.33 | -16.16 | 0 | 7 | 0 | 61 | 361.471 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.48 | 6.63 | -45.17 | 1 | 7 | 1 | 62 | 362.479 | 4 | ↓ |