UCSF

ZINC65733922

Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2011 25 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) -0.92 1.14 -21.44 2 11 0 150 360.319 8
Hi High (pH 8-9.5) -0.92 3.01 -74.9 1 11 -1 153 359.311 8
Hi High (pH 8-9.5) -0.92 2.17 -75.02 1 11 -1 153 359.311 8

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

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