UCSF

ZINC62041337

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2011 23 Yes

Popular Name: N-(4-methyl-2-pyridyl)-2-methylsulfanyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-amine N-(4-methyl-2-pyridyl)-2-methyls…

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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) 5.56 11.07 -9.26 1 4 0 51 342.493 3 ↓
Mid Mid (pH 6-8) 5.56 11.49 -34.44 2 4 1 52 343.501 3 ↓

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

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