UCSF

ZINC02797418

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2004 26 Yes

Popular Name: 2-[(6-amino-4-keto-1-phenyl-pyrimidin-3-ium-2-yl)thio]-N-(2-chlorophenyl)acetamide 2-[(6-amino-4-keto-1-phenyl-pyri…

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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) 2.98 8.37 -34.85 4 6 1 91 387.872 5 ↓
Mid Mid (pH 6-8) 2.98 7.38 -18.46 3 6 0 90 386.864 5 ↓

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

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