UCSF

ZINC57729672

Substance Information

In ZINC since Heavy atoms Benign functionality
January 24th, 2011 29 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) 2.33 9.32 -37.71 3 6 1 70 389.479 3
Hi High (pH 8-9.5) 2.33 7.25 -8 2 6 0 68 388.471 3

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

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