UCSF

ZINC38141462

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 4th, 2010 22 No

Popular Name: ium ium

Find On: PubMed — Wikipedia — Google

CAS Numbers: 139-07-1 , 7281-04-1 , [139-07-1] , [7281-04-1]

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) 3.44 16.34 -31.8 0 1 1 0 304.542 13 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 60? Alfa-Aesar

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