UCSF

ZINC38269494

Substance Information

In ZINC since Heavy atoms Benign functionality
January 13th, 2010 29 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) 0.37 1.75 -171.47 3 9 -2 159 428.374 11
Mid Mid (pH 6-8) 0.37 0.61 -64.89 4 9 -1 157 429.382 11

Activity (Go SEA)

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