UCSF

ZINC00116822

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 20 Yes

Popular Name: methyl 3-amino-5-[4-(tert-butyl)phenyl]thiophene-2-carboxylate methyl 3-amino-5-[4-(tert-butyl)…

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CAS Numbers: 175201-46-4 , [175201-46-4]

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) 4.71 0.95 -6.71 2 3 0 52 289.4 4 ↓

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