UCSF

ZINC57304892

Substance Information

In ZINC since Heavy atoms Benign functionality
January 19th, 2011 20 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) 0.63 2.72 -12.31 2 6 0 79 279.34 3
Hi High (pH 8-9.5) 0.81 0.07 -43.97 1 6 -1 85 278.332 3

Activity (Go SEA)

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