UCSF

ZINC13404022

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 18th, 2008 37 No

Popular Name: (2E)-2-[(2E)-2-[2-chloro-3-[(Z)-2-(1,3,3,5-tetramethylindol-1-ium-2-yl)vinyl]-1-cyclohex-2-enylidene (2E)-2-[(2E)-2-[2-chloro-3-[(Z)-…

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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) 5.78 20.37 -23.73 0 2 1 6 512.161 3 ↓

Vendor Notes

Note Type Comments Provided By
mp 266 - 270 MolMall (formerly Molecular Diversity Preservation International)

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Rings

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

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