UCSF

ZINC61322155

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 8th, 2011 19 No

Popular Name: 3-[(5-methylpyrazin-2-yl)methyl]-2-sulfanyl-thieno[3,2-d]pyrimidin-4-one 3-[(5-methylpyrazin-2-yl)methyl]…

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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) 1.60 3.94 -44.56 0 5 -1 67 289.365 2 ↓
Mid Mid (pH 6-8) 1.15 5.31 -13.65 1 5 0 64 290.373 2 ↓

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

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