UCSF

ZINC05186795

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 25th, 2006 17 No

Popular Name: 1-(3-nitro-4-pyrrolidin-1-ylphenyl)ethanone 1-(3-nitro-4-pyrrolidin-1-ylphen…

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CAS Numbers: , 887595-31-5

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) 2.23 1.38 -14.98 0 5 0 66 234.255 3 ↓

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