UCSF

ZINC03897607

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 16th, 2005 13 No

Popular Name: 6-nitro-2,3-dihydro-1,4-benzodioxine 6-nitro-2,3-dihydro-1,4-benzodio…

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CAS Numbers: 16498-20-7 , [16498-20-7]

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) 1.41 4.32 -7.38 0 5 0 64 181.147 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 121 TCI
Purity 95% Fluorochem

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