UCSF

ZINC19992727

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2008 26 Yes

Popular Name: 3-[(4-oxo-5-tetralin-6-yl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanoic 3-[(4-oxo-5-tetralin-6-yl-3H-thi…

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Vendors

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) 4.64 10.22 -61.25 1 5 -1 86 385.49 5 ↓
Hi High (pH 8-9.5) 5.10 8.98 -112.39 0 5 -2 89 384.482 5 ↓

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

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