UCSF

ZINC52819767

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2010 22 No

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Annotations

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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) 1.32 8.67 -60.36 0 7 -1 77 325.414 6
Lo Low (pH 4.5-6) 0.60 8.77 -23.43 1 7 0 80 326.422 6

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

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