UCSF

ZINC14241875

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 5th, 2008 20 No

Popular Name: 2-(4-chloro-3-nitro-phenyl)-3H-thieno[3,2-e]pyrimidin-4-one 2-(4-chloro-3-nitro-phenyl)-3H-t…

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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) 3.42 6.77 -14.52 1 6 0 92 307.718 2 ↓
Hi High (pH 8-9.5) 3.88 5.83 -38.93 0 6 -1 95 306.71 2 ↓

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

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