UCSF

ZINC39207825

Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2010 14 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) 2.68 6.28 -9.21 1 2 0 29 182.226 0
Lo Low (pH 4.5-6) 2.68 6.72 -29.38 2 2 1 30 183.234 0

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

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