In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2011 | 28 | No |
Popular Name: N-benzyl-4-methoxy-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]butan-1-amine N-benzyl-4-methoxy-N-[(6-nitro-4…
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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) | 3.34 | 11.2 | -46.06 | 1 | 7 | 1 | 78 | 387.456 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.34 | 9.05 | -8.32 | 0 | 7 | 0 | 77 | 386.448 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.