UCSF

ZINC02554037

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 19 Yes

Popular Name: 5-(4- tert -Butyl-phenyl)-4-methyl-thiophene-2-carboxylic acid 5-(4- tert -Butyl-phenyl)-4-meth…

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CAS Number: 861432-72-6

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) 5.41 1.52 -50.93 0 2 -1 40 273.377 3 ↓

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