UCSF

ZINC12539072

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 17th, 2008 28 No

Popular Name: (2E)-2-(3-methyl-1,3-benzothiazol-2-ylidene)-3-oxo-4-(2-oxochromen-7-yl)oxy-butanenitrile (2E)-2-(3-methyl-1,3-benzothiazo…

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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) 3.35 12.15 -21.43 0 6 0 85 390.42 4 ↓

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

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