UCSF

ZINC66166979

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 20th, 2011 28 No

Popular Name: 3-dodecyl-1-methyl-benzo[f]benzotriazol-1-ium-4,9-dione 3-dodecyl-1-methyl-benzo[f]benzo…

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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) 2.80 13.78 -24.26 0 5 1 56 382.528 11 ↓

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Rings

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

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