UCSF

ZINC33931047

Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2009 34 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) 1.10 10.29 -43.45 2 9 0 130 466.49 9
Hi High (pH 8-9.5) 1.10 9.06 -51.38 1 9 -1 125 465.482 9

Activity (Go SEA)

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