UCSF

ZINC69688003

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2011 21 No

Popular Name: 3-[[(5-bromo-2-furyl)methyl-methyl-amino]methyl]-5-pyrrolidin-1-yl-1,3,4-thiadiazole-2-thione 3-[[(5-bromo-2-furyl)methyl-meth…

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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) 2.62 10.37 -38.02 1 5 1 39 390.352 5 ↓
Hi High (pH 8-9.5) 2.62 7.93 -8.92 0 5 0 37 389.344 5 ↓

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

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