UCSF

ZINC31892243

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 21 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) 2.92 9.56 -68.52 1 4 0 54 289.375 6
Hi High (pH 8-9.5) 2.92 7.22 -58.69 0 4 -1 53 288.367 6

Activity (Go SEA)

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