UCSF

ZINC66449450

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Substance Information

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

Popular Name: 5-(dimethylamino)-3-[[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methyl]-1,3,4-thiadiazole-2-thione 5-(dimethylamino)-3-[[4-[(2-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) 1.93 6.46 -10.83 0 6 0 37 379.555 6 ↓
Mid Mid (pH 6-8) 1.93 8.77 -36.8 1 6 1 38 380.563 6 ↓

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

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