| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 5th, 2011 | 25 | No |
Popular Name: N-[(5-methyl-2-thienyl)methyl]-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]propan-2-amine N-[(5-methyl-2-thienyl)methyl]-N…
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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) | 3.61 | 8.72 | -8.43 | 0 | 6 | 0 | 68 | 362.451 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.61 | 10.65 | -40.85 | 1 | 6 | 1 | 69 | 363.459 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
