UCSF

ZINC36970597

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2009 20 Yes

Popular Name: 2-[2-[(5-hydroxy-4-oxo-pyran-2-yl)methylsulfanyl]-4-methyl-thiazol-5-yl]acetic 2-[2-[(5-hydroxy-4-oxo-pyran-2-y…

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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) 0.91 5.51 -96.78 0 6 -2 106 311.34 5 ↓
Mid Mid (pH 6-8) 0.91 4.65 -54.38 1 6 -1 103 312.348 5 ↓

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

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