UCSF

ZINC66668937

Substance Information

In ZINC since Heavy atoms Benign functionality
August 29th, 2011 27 No

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Annotations

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Vendors

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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) 3.64 11.81 -98.73 4 5 2 50 394.629 11
Mid Mid (pH 6-8) 3.64 9.55 -44.48 3 5 1 49 393.621 11

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

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