UCSF

ZINC32786948

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2009 27 No

Popular Name: (E)-N-[2-[[4-methyl-5-(1-methylimidazol-2-yl)thiazol-2-yl]amino]-2-oxo-ethyl]-3-phenyl-prop-2-enamid (E)-N-[2-[[4-methyl-5-(1-methyli…

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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) 2.51 7.99 -21.3 2 7 0 89 381.461 6 ↓
Hi High (pH 8-9.5) 2.33 6.91 -44.81 1 7 -1 95 380.453 6 ↓

Activity (Go SEA)

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