UCSF

ZINC49569551

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 16 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) 1.77 6.96 -83.43 3 3 2 30 241.404 2
Hi High (pH 8-9.5) 1.77 4.7 -25.37 2 3 1 29 240.396 2

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

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