UCSF

ZINC71566197

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 25 No

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Annotations

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Vendors

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) 4.36 10.47 -11.96 1 4 0 46 331.419 5
Mid Mid (pH 6-8) 4.36 10.98 -30.57 2 4 1 48 332.427 5

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

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