UCSF

ZINC01662513

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 12 Yes

Popular Name: m-Tolylsulfanyl-acetic acid m-Tolylsulfanyl-acetic acid

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CAS Numbers: 349-83-7 , 3996-30-3

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) 2.04 0.58 -45.56 0 2 -1 40 181.236 3 ↓

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