UCSF

ZINC31975523

Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 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) 2.33 7.07 -74.27 3 6 1 91 269.284 3
Hi High (pH 8-9.5) 2.33 6.75 -15.9 2 6 0 89 268.276 3

Activity (Go SEA)

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