| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 29th, 2009 | 26 | No |
Popular Name: (4-benzylpiperazin-1-yl)-[(2S,4R)-2-(3-pyridyl)thiazolidin-4-yl]methanone (4-benzylpiperazin-1-yl)-[(2S,4R…
None
| 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) | 1.45 | 5.75 | -13.03 | 1 | 5 | 0 | 48 | 368.506 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.45 | 7.96 | -55.12 | 2 | 5 | 1 | 50 | 369.514 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.45 | 8.41 | -93.42 | 3 | 5 | 2 | 51 | 370.522 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4987132 | IBM Patent Data |
