| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 29th, 2006 | 16 | Yes |
Popular Name: 1-Butylquinoline-2,4(1H,3H)-dione 1-Butylquinoline-2,4(1H,3H)-dione
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CAS Numbers: , 883797-61-3
| 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) | 1.74 | 6.9 | -8.42 | 0 | 3 | 0 | 37 | 217.268 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.28 | 5.85 | -50.82 | 0 | 3 | -1 | 45 | 216.26 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
