UCSF

ZINC67427955

Substance Information

In ZINC since Heavy atoms Benign functionality
September 9th, 2011 27 No

Download: MOL2 SDF SMILES Flexibase

Annotations

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Vendors

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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) 4.29 9.82 -14.25 1 5 0 72 386.448 5
Mid Mid (pH 6-8) 4.75 10.1 -42.65 0 5 -1 75 385.44 5

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

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