UCSF

ZINC16878373

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2008 27 No

Popular Name: N-methyl-4-[[methyl-[(1-thioxo-[1,2,4]triazolo[3,4-b][1,3]benzothiazol-2-yl)methyl]amino]methyl]benz N-methyl-4-[[methyl-[(1-thioxo-[…

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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) 2.67 12.14 -50.8 2 6 1 56 398.537 5 ↓
Mid Mid (pH 6-8) 2.67 9.67 -18.06 1 6 0 55 397.529 5 ↓

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

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