UCSF

ZINC59819552

Substance Information

In ZINC since Heavy atoms Benign functionality
March 11th, 2011 46 No

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Annotations

Vendors

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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) 6.87 15.97 -56.23 2 9 -1 121 617.726 7
Lo Low (pH 4.5-6) 6.87 16.44 -78.58 3 9 0 123 618.734 7

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

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