UCSF

ZINC06075241

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 4th, 2006 31 Yes

Popular Name: 6-tert-butyl-2-[(2-chlorobenzyl)sulfanyl]-4-phenyl-5,6,7,8-tetrahydro-3-quinolinecarbonitrile 6-tert-butyl-2-[(2-chlorobenzyl)…

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CAS Number: 309278-44-2

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) 8.24 2.98 -7.84 0 2 0 36 447.047 5 ↓

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