UCSF

ZINC65536252

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 28 No

Popular Name: 5-(5-bromo-2-isopropoxybenzylidene)-3-phenyl-2-(phenylimino)-1,3-thiazolidin-4-one 5-(5-bromo-2-isopropoxybenzylide…

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Other Names:

MFCD01160845

Download: MOL2 SDF SMILES Flexibase

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) 2.09 6.76 -40.36 2 7 1 90 382.44 4 ↓
Mid Mid (pH 6-8) 2.09 6.34 -15.92 1 7 0 89 381.432 4 ↓

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

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