UCSF

ZINC66054851

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 18th, 2011 16 Yes

Popular Name: 6-BROMO-2',3',5',6'-TETRAHYDROSPIRO[INDENE-2,4'-PYRAN]-1(3H)-ONE 6-BROMO-2',3',5',6'-TETRAHYDROSP…

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CAS Number: 1245514-78-6

Other Names:

MFCD18711529

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) 2.69 6.62 -8.02 0 2 0 26 281.149 0 ↓

Vendor Notes

Note Type Comments Provided By
Purity 97% Fluorochem

Activity (Go SEA)

Rings

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

No pre-computed analogs available. Try a structural similarity search.