UCSF

ZINC59148360

Substance Information

In ZINC since Heavy atoms Benign functionality
February 26th, 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) 3.68 8.35 -55.81 3 3 1 48 277.432 9
Hi High (pH 8-9.5) 3.68 7.95 -8.65 2 3 0 46 276.424 9

Activity (Go SEA)

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