UCSF

ZINC54424988

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 3rd, 2010 22 No

Popular Name: 5-tert-butyl-3-[[(4-methoxyphenyl)methyl-methyl-amino]methyl]-1,3,4-oxadiazole-2-thione 5-tert-butyl-3-[[(4-methoxypheny…

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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) 3.16 7.54 -43.5 1 5 1 45 322.454 6 ↓
Hi High (pH 8-9.5) 3.16 4.9 -10.21 0 5 0 43 321.446 6 ↓

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

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