UCSF

ZINC52818154

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2010 21 Yes

Popular Name: N-methyl-3-(4-methyl-2-oxo-thiazol-3-yl)-N-[2-(2-pyridyl)ethyl]propanamide N-methyl-3-(4-methyl-2-oxo-thiaz…

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Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 0.86 6.84 -15.01 0 5 0 55 305.403 6 ↓
Lo Low (pH 4.5-6) 0.86 7.2 -40.87 1 5 1 56 306.411 6 ↓

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

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