UCSF

ZINC48984737

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2010 17 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) 1.39 2.9 -44.23 0 4 -1 56 269.371 1
Mid Mid (pH 6-8) 0.93 4.75 -13.37 1 4 0 53 270.379 1

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

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