UCSF

ZINC49512906

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2010 34 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) 0.63 5.05 -13.54 2 9 0 96 465.554 6
Lo Low (pH 4.5-6) 0.63 7.17 -46.51 3 9 1 97 466.562 6

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

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