UCSF

ZINC40345923

Substance Information

In ZINC since Heavy atoms Benign functionality
April 6th, 2010 26 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) 0.73 3.84 -21.88 3 8 0 113 375.768 5
Hi High (pH 8-9.5) 2.03 3.71 -48.71 2 8 -1 117 374.76 5

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

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