UCSF

ZINC48794124

Substance Information

In ZINC since Heavy atoms Benign functionality
September 19th, 2010 19 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) -0.30 -1.61 -15.94 3 8 0 105 265.273 5
Hi High (pH 8-9.5) -0.12 -4.25 -46.84 2 8 -1 111 264.265 5

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

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