UCSF

ZINC54699594

Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2010 18 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) 1.98 6.51 -15.97 1 4 0 55 256.334 2
Mid Mid (pH 6-8) 2.89 6.32 -9.5 2 4 0 57 256.334 2

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

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