UCSF

ZINC59110617

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 25th, 2011 30 No

Popular Name: N-(4-cyanophenyl)-N-[3,4-dioxo-2-[[(1R)-1,2,2-trimethylpropyl]amino]cyclobuten-1-yl]benzamide N-(4-cyanophenyl)-N-[3,4-dioxo-2…

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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) 2.98 10.7 -13.2 0 6 0 91 401.466 5 ↓
Mid Mid (pH 6-8) 2.98 9.52 -11.67 0 6 0 91 401.466 5 ↓

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

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