UCSF

ZINC66447554

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2011 22 No

Popular Name: 3-[[2-(3-chlorophenoxy)ethyl-methyl-amino]methyl]-5-(dimethylamino)-1,3,4-thiadiazole-2-thione 3-[[2-(3-chlorophenoxy)ethyl-met…

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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) 2.97 7.85 -13.76 0 5 0 34 358.92 7 ↓
Lo Low (pH 4.5-6) 2.97 10.36 -42.71 1 5 1 35 359.928 7 ↓

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

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