UCSF

ZINC57294160

Substance Information

In ZINC since Heavy atoms Benign functionality
January 19th, 2011 18 No

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Annotations

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) 1.38 3.73 -50.82 1 5 -1 77 244.274 4
Lo Low (pH 4.5-6) 1.31 5.18 -8.68 2 5 0 71 245.282 3

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

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