UCSF

ZINC42065265

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2010 20 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) 1.22 5.98 -46.5 3 7 0 103 290.304 4
Mid Mid (pH 6-8) 1.94 5.64 -68.97 2 7 -1 100 289.296 4

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

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