UCSF

ZINC34651177

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2009 17 Yes

Popular Name: (S)-(-)-N-tert-Butyl-1,2,3,4-tetrahydro-3-isoquinolinecarboxamide (S)-(-)-N-tert-Butyl-1,2,3,4-tet…

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CAS Numbers: 149182-72-9 , 153290-82-5

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) 1.77 3.75 -6.73 2 3 0 41 232.327 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 96 - 98 KeyOrganics

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