UCSF

ZINC67974266

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2011 28 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) 2.10 13.19 -93.39 2 5 2 46 387.568 8
Hi High (pH 8-9.5) 2.10 10.67 -44.45 1 5 1 45 386.56 8

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

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