UCSF

ZINC59818745

Substance Information

In ZINC since Heavy atoms Benign functionality
March 11th, 2011 42 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) 6.97 15.36 -18.9 2 7 0 84 567.73 7
Lo Low (pH 4.5-6) 6.97 17.63 -48.47 3 7 1 85 568.738 7

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

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