UCSF

ZINC55502082

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 15th, 2010 21 Yes

Popular Name: N,5-dimethyl-4-oxo-2-(2-pyridyl)-3H-thieno[2,3-d]pyrimidine-6-carboxamide N,5-dimethyl-4-oxo-2-(2-pyridyl)…

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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) 1.52 2.47 -20.78 2 6 0 88 300.343 2 ↓
Mid Mid (pH 6-8) 1.98 1.18 -51.04 1 6 -1 91 299.335 2 ↓

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

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