UCSF

ZINC36226496

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 16 No

Popular Name: 1-(5-Bromo-3-nitropyridin-2-yl)piperazine 1-(5-Bromo-3-nitropyridin-2-yl)p…

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CAS Numbers: 1203499-08-4 , N/A , [1203499-08-4]

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) 1.30 5.56 -43.63 2 6 1 79 288.125 2 ↓
Hi High (pH 8-9.5) 1.30 4.25 -4.8 1 6 0 74 287.117 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 89 - 90 KeyOrganics
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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