UCSF

ZINC63250562

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 27th, 2011 23 No

Popular Name: N-allyl-N-[(3-nitrophenyl)methyl]-1-oxido-pyridin-1-ium-3-carboxamide N-allyl-N-[(3-nitrophenyl)methyl…

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Physical Representations

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) 0.40 8.95 -34.11 0 7 0 92 313.313 6 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.