| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 29th, 2011 | 29 | Yes |
Popular Name: 4-[[6-(diethylamino)-3-pyridyl]methylcarbamoylamino]-N-isopropyl-2-methyl-benzamide 4-[[6-(diethylamino)-3-pyridyl]m…
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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) | 3.05 | 8.56 | -40.36 | 4 | 7 | 1 | 88 | 398.531 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.05 | 8.19 | -12.87 | 3 | 7 | 0 | 86 | 397.523 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
