UCSF

ZINC67240605

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 7th, 2011 24 No

Popular Name: 4-[(E)-1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-7-yliminomethyl]-5-(hydroxymethyl)-2-methyl-pyridi 4-[(E)-1,2-dihydroimidazo[2,1-b]…

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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) 3.73 2.79 -34.89 3 6 1 85 341.416 3 ↓
Hi High (pH 8-9.5) 3.73 2.51 -47.37 1 6 -1 86 339.4 3 ↓
Mid Mid (pH 6-8) 3.73 1.74 -12.97 2 6 0 83 340.408 3 ↓

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

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