UCSF

ZINC49389562

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 28th, 2010 18 No

Popular Name: 3-[[methyl-[(2-methylthiazol-4-yl)methyl]amino]methyl]-5-methylsulfanyl-1,3,4-thiadiazole-2-thione 3-[[methyl-[(2-methylthiazol-4-y…

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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) 1.41 4.95 -8.68 0 4 0 34 318.518 5 ↓
Lo Low (pH 4.5-6) 1.41 7.44 -35.17 1 4 1 35 319.526 5 ↓

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

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