UCSF

ZINC57946099

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2011 28 No

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Annotations

None

Vendors

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) 2.95 6.98 -13.44 3 7 0 100 399.834 7
Hi High (pH 8-9.5) 3.14 6.23 -54.5 2 7 -1 107 398.826 7

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

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