UCSF

ZINC66129687

Substance Information

In ZINC since Heavy atoms Benign functionality
August 19th, 2011 42 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) 5.19 9.31 -58.02 3 9 1 107 574.698 9
Mid Mid (pH 6-8) 5.19 7.02 -15.27 2 9 0 106 573.69 9

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

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