UCSF

ZINC13405006

Substance Information

In ZINC since Heavy atoms Benign functionality
June 18th, 2008 11 Yes

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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) 0.31 1.76 -6.22 1 2 0 33 147.177 0
Lo Low (pH 4.5-6) 0.31 2.03 -33.92 2 2 1 34 148.185 0

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

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