In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 19 | Yes |
Popular Name: [(3S)-3-piperidyl]-(4-thiazol-2-ylpiperazin-1-yl)methanone [(3S)-3-piperidyl]-(4-thiazol-2-…
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) | 0.51 | 3.71 | -54.32 | 2 | 5 | 1 | 53 | 281.405 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.51 | 4.16 | -99.81 | 3 | 5 | 2 | 54 | 282.413 | 2 | ↓ |