UCSF

ZINC66883557

Substance Information

In ZINC since Heavy atoms Benign functionality
September 2nd, 2011 25 Yes

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) 1.62 8.34 -57.22 1 6 1 70 361.491 5
Mid Mid (pH 6-8) 1.62 6.13 -20.77 0 6 0 69 360.483 5

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

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