UCSF

ZINC69797346

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2011 22 No

Popular Name: 3-[[cyclopropylmethyl(ethyl)amino]methyl]-5-(2-methoxyphenyl)-1,3,4-oxadiazole-2-thione 3-[[cyclopropylmethyl(ethyl)amin…

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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) 2.94 7.94 -34.38 1 5 1 45 320.438 7 ↓
Hi High (pH 8-9.5) 2.94 5.59 -9.77 0 5 0 43 319.43 7 ↓

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

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