UCSF

ZINC63941564

Substance Information

In ZINC since Heavy atoms Benign functionality
June 8th, 2011 23 No

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Annotations

None

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) 1.63 3.36 -14.64 2 6 0 83 346.696 5
Hi High (pH 8-9.5) 1.82 2.58 -50.52 1 6 -1 89 345.688 5

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

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