UCSF

ZINC03884568

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 22 No

Popular Name: 1-nitro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid 1-nitro-9,10-dioxo-9,10-dihydroa…

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CAS Numbers: 128-67-6 , [128-67-6]

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) 3.62 2.24 -57.03 0 7 -1 120 296.214 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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