UCSF

ZINC66157271

Substance Information

In ZINC since Heavy atoms Benign functionality
August 20th, 2011 45 No

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Annotations

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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) 6.33 11.34 -14.86 1 9 0 97 609.675 10
Mid Mid (pH 6-8) 6.33 11.97 -60.38 0 9 -1 100 608.667 10

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

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