UCSF

ZINC40767842

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2010 27 Yes

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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) 1.45 5.05 -16.6 2 8 0 94 365.393 5
Mid Mid (pH 6-8) 1.45 5.48 -38.89 3 8 1 95 366.401 5

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

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