UCSF

ZINC71538575

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 30 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) 2.48 6.77 -26.27 1 8 0 100 444.538 3
Hi High (pH 8-9.5) 2.48 6.54 -69.85 0 8 -1 103 443.53 3

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

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