UCSF

ZINC55528813

Substance Information

In ZINC since Heavy atoms Benign functionality
December 15th, 2010 22 No

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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) 3.55 8.09 -36.27 0 5 -1 67 317.39 3
Mid Mid (pH 6-8) 3.09 9.35 -9.36 1 5 0 64 318.398 3

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

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