UCSF

ZINC14942807

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2008 24 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) 0.65 0.81 -16.03 5 8 0 128 345.44 9
Hi High (pH 8-9.5) 0.65 2.02 -55.67 4 8 -1 131 344.432 9

Activity (Go SEA)

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