UCSF

ZINC22686398

Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2008 35 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) 2.77 9.2 -16.43 1 8 0 88 483.609 9
Lo Low (pH 4.5-6) 2.77 11.15 -53.16 2 8 1 89 484.617 9

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

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