UCSF

ZINC24991001

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2009 23 No

Popular Name: 3-[[(4-bromophenyl)methyl-methyl-amino]methyl]-5-(pyrrolidin-1-ylmethyl)-1,3,4-oxadiazole-2-thione 3-[[(4-bromophenyl)methyl-methyl…

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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 8.74 -111.69 2 5 2 40 399.358 6 ↓
Mid Mid (pH 6-8) 2.42 6.2 -44.84 1 5 1 39 398.35 6 ↓

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