UCSF

ZINC62942296

Substance Information

In ZINC since Heavy atoms Benign functionality
May 19th, 2011 35 No

Download: MOL2 SDF SMILES Flexibase

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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) 6.25 14.4 -71.8 1 4 0 44 490.448 7
Mid Mid (pH 6-8) 6.25 14.29 -9.68 0 4 0 43 489.44 7

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

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