UCSF

ZINC66251040

Substance Information

In ZINC since Heavy atoms Benign functionality
August 22nd, 2011 43 No

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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) -1.56 -0.42 -126.19 8 17 -1 266 601.645 16
Mid Mid (pH 6-8) -1.56 -0.89 -115.06 7 17 -2 264 600.637 16

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

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