UCSF

ZINC04782838

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 3rd, 2006 19 No

Popular Name: 4-(3-bromopropoxy)-5-methoxy-2-nitrobenzoic acid 4-(3-bromopropoxy)-5-methoxy-2-n…

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CAS Numbers: , 343308-52-1

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) 2.57 0.8 -54.86 0 7 -1 104 333.114 7 ↓

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