UCSF

ZINC65598255

Substance Information

In ZINC since Heavy atoms Benign functionality
July 22nd, 2011 27 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) 2.14 5.61 -43.59 4 7 1 84 383.557 9
Mid Mid (pH 6-8) 2.14 3.47 -12.46 3 7 0 83 382.549 9

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

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