UCSF

ZINC36383912

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2009 17 No

Popular Name: 2-amino-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide 2-amino-6-tert-butyl-4,5,6,7-tet…

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CAS Number: 68746-25-8

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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) 2.24 3.46 -4.79 3 3 0 67 252.383 2 ↓
Mid Mid (pH 6-8) 2.93 2.68 -8.33 4 3 0 69 252.383 2 ↓
Mid Mid (pH 6-8) 2.24 2.84 -11.36 3 3 0 67 252.383 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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