| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2008 | 34 | No |
Popular Name: 2-[4-(4-tert-butylbenzoyl)piperazin-1-yl]-N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]acetamide 2-[4-(4-tert-butylbenzoyl)pipera…
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| 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) | 4.55 | 11.64 | -40.79 | 1 | 7 | 0 | 86 | 477.634 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.55 | 9.42 | -46.57 | 0 | 7 | -1 | 85 | 476.626 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.73 | 10.36 | -24.12 | 1 | 7 | 0 | 78 | 477.634 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.73 | 12.71 | -60.21 | 2 | 7 | 1 | 80 | 478.642 | 6 | ↓ |
