UCSF

ZINC19993060

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2008 34 Yes

Popular Name: 2-[2-(1-naphthyloxy)ethylsulfanyl]-5-tetralin-6-yl-3H-thieno[3,2-e]pyrimidin-4-one 2-[2-(1-naphthyloxy)ethylsulfany…

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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) 7.97 14.43 -21.16 1 4 0 55 484.646 6 ↓
Mid Mid (pH 6-8) 8.35 13.19 -52.38 0 4 -1 58 483.638 6 ↓

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

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