UCSF

ZINC04736918

Substance Information

In ZINC since Heavy atoms Benign functionality
January 2nd, 2006 26 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) 1.96 6.98 -25.38 1 7 0 82 363.389 9
Mid Mid (pH 6-8) 2.06 0.59 -54.35 1 7 1 82 364.397 9

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

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