UCSF

ZINC02155962

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 29 No

Popular Name: (2Z,5E)-5-(3-allyl-5-ethoxy-4-hydroxy-benzylidene)-2-(5-chloro-2-methyl-phenyl)imino-thiazolidin-4-o (2Z,5E)-5-(3-allyl-5-ethoxy-4-hy…

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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) 6.39 9.57 -9.87 2 5 0 75 428.941 6 ↓
Ref Reference (pH 7) 6.39 9.85 -10.71 2 5 0 75 428.941 6 ↓
Hi High (pH 8-9.5) 6.85 7.82 -42.4 1 5 -1 78 427.933 6 ↓
Hi High (pH 8-9.5) 6.85 8.32 -42.02 1 5 -1 78 427.933 6 ↓

Activity (Go SEA)

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