UCSF

ZINC35543913

Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2009 32 No

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 4.12 13.14 -50.14 2 7 1 83 435.548 5
Mid Mid (pH 6-8) 4.12 10.9 -11.49 1 7 0 81 434.54 5

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