UCSF

ZINC21529484

Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 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) 3.73 14.34 -52.64 2 7 1 84 493.653 7
Mid Mid (pH 6-8) 3.73 11.96 -19.08 1 7 0 83 492.645 7

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

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