UCSF

ZINC06016342

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 24th, 2006 18 No

Popular Name: 5-Butyl-6-mercapto-1,2,3,5-tetrahydro-8-thia-5,7-diaza-cyclopenta[a]inden-4-one 5-Butyl-6-mercapto-1,2,3,5-tetra…

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CAS Number: 380467-88-9

Other Names:

MFCD02631128

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) 2.89 8.89 -9.12 1 3 0 38 280.418 3 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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