UCSF

ZINC01363004

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 19 Yes

Popular Name: 3-{[(thien-2-ylmethyl)amino]sulfonyl}benzoic acid 3-{[(thien-2-ylmethyl)amino]sulf…

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CAS Number: 603118-17-8

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) 2.19 4.19 -53.21 1 5 -1 86 296.349 5 ↓

Vendor Notes

Note Type Comments Provided By
MP 223 - 225 Enamine Building Blocks
MP 223...225 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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