UCSF

ZINC54705390

Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2010 23 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) 0.60 2.18 -16.7 2 7 0 88 317.345 3
Hi High (pH 8-9.5) 0.79 -0.47 -47.81 1 7 -1 94 316.337 3

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

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