UCSF

ZINC54454025

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 3rd, 2010 25 No

Popular Name: 2-[4-[(5-tert-butyl-2-thioxo-1,3,4-oxadiazol-3-yl)methyl]piperazin-1-yl]-N-[(1S)-1-methylpropyl]acet 2-[4-[(5-tert-butyl-2-thioxo-1,3…

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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) 2.42 5.18 -39.69 2 7 1 68 370.543 7 ↓
Mid Mid (pH 6-8) 2.42 2.61 -13.05 1 7 0 67 369.535 7 ↓

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

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