UCSF

ZINC00420800

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 19 Yes

Popular Name: 1-[4-(azepan-1-ylsulfonyl)phenyl]ethanone 1-[4-(azepan-1-ylsulfonyl)phenyl…

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CAS Number: 333787-87-4

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) 2.56 -2.91 -11.19 0 4 0 54 281.377 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 73 - 77 Enamine Building Blocks
MP 74 - 76 Enamine Building Blocks
MP 74...76 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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