UCSF

ZINC65525944

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2011 29 No

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Annotations

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Vendors

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) 1.67 5.08 -111.1 4 8 2 88 391.479 3
Lo Low (pH 4.5-6) 1.67 5.44 -156.35 5 8 3 90 392.487 3

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

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