UCSF

ZINC35497512

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2009 30 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) 2.49 9.79 -48.69 1 7 1 67 404.446 5
Mid Mid (pH 6-8) 2.49 9.82 -11.55 0 7 0 66 403.438 5

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

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