UCSF

ZINC49549457

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 28 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) -0.14 5.99 -82.06 4 8 1 116 404.468 7
Hi High (pH 8-9.5) -0.14 3.87 -36.04 3 8 0 115 403.46 7

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

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