UCSF

ZINC71554436

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 30 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) 3.24 11.25 -13.07 1 6 0 66 422.554 5
Mid Mid (pH 6-8) 3.24 11.57 -36.09 2 6 1 67 423.562 5

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

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