UCSF

ZINC33761804

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2009 33 No

Popular Name: (4Z,5R)-1-(5-acetyl-4-methyl-thiazol-2-yl)-5-(4-hydroxy-3-methoxy-phenyl)-4-[hydroxy(4-pyridyl)methy (4Z,5R)-1-(5-acetyl-4-methyl-thi…

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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) 1.54 6.68 -45.16 1 9 -1 133 464.479 6 ↓
Hi High (pH 8-9.5) 1.54 7.48 -103.61 0 9 -2 136 463.471 6 ↓
Lo Low (pH 4.5-6) 1.54 5.39 -21.71 2 9 0 130 465.487 6 ↓

Activity (Go SEA)

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