UCSF

ZINC00037781

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 13 No

Popular Name: 4-Chloro-2-ethoxy-1-nitrobenzene 4-Chloro-2-ethoxy-1-nitrobenzene

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CAS Numbers: 29604-25-9 , [29604-25-9]

Other Names:

AN-1057

MFCD02625956

Download: MOL2 SDF SMILES Flexibase

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) 2.94 2.07 -7.32 0 4 0 55 201.609 3 ↓

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

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