UCSF

ZINC35270421

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2009 17 No

Popular Name: (1-(5-Bromo-3-nitropyridin-2-yl)pyrrolidin-3-yl)methanol (1-(5-Bromo-3-nitropyridin-2-yl)…

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CAS Numbers: 1138444-02-6 , [1138444-02-6]

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) 1.88 4.65 -6.18 1 6 0 82 302.128 3 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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