UCSF

ZINC22717308

Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2008 33 No

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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) 3.32 8.96 -29.07 2 8 0 108 480.571 8
Mid Mid (pH 6-8) 3.32 8.99 -63.61 1 8 -1 110 479.563 8

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

No pre-computed analogs available. Try a structural similarity search.