UCSF

ZINC08730080

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2007 19 No

Popular Name: N-(4-fluoro-3-nitrophenyl)-2-(1-pyrrolidinyl)acetamide N-(4-fluoro-3-nitrophenyl)-2-(1-…

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CAS Numbers: 952182-62-6 , N/A

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) 1.97 1.1 -53.38 2 6 1 79 268.268 4 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 105 - 106 KeyOrganics
MP 105-106° Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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