UCSF

ZINC65734198

Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2011 24 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) 0.77 6.67 -30.87 2 9 0 122 351.75 5
Mid Mid (pH 6-8) 0.77 7.1 -49.57 3 9 1 123 352.758 5

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

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