UCSF

ZINC00967474

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2005 8 No

Popular Name: Thiazolidine-4-carboxylic acid Thiazolidine-4-carboxylic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 2756-91-4 , 34292-47-7 , 34592-47-7 , 444-27-9 , 45521-09-3 , 60731-25-1 , [34592-47-7] , [444-27-9] , [45521-09-3]

Download: MOL2 SDF SMILES Flexibase

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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) -1.75 -2.19 -37.57 2 3 0 56 133.172 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 190 - 200 Enamine Building Blocks
MP 190...200 Enamine Building Blocks
MP 191-200° Matrix Scientific
MP 192 - 193 Enamine Building Blocks
MP 192...193 Enamine Building Blocks
BP 350° Matrix Scientific
ALOGPS_SOLUBILITY 8.40e+01 g/l DrugBank-experimental
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Therapy hepatoprotectant SMDC Pharmakon
Warnings IRRITANT Matrix Scientific
Warnings Toxic Matrix Scientific
PUBCHEM_PATENT_ID US4032534; US4288453 IBM Patent Data

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.