In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2010 | 19 | Yes |
Popular Name: 2-[(2S)-pyrrolidin-2-yl]-1-(4-thiazol-2-ylpiperazin-1-yl)ethanone 2-[(2S)-pyrrolidin-2-yl]-1-(4-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) | 1.98 | 5.47 | -38.69 | 2 | 5 | 1 | 53 | 281.405 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.98 | 5.91 | -77.05 | 3 | 5 | 2 | 54 | 282.413 | 3 | ↓ |