UCSF

ZINC49398322

Substance Information

In ZINC since Heavy atoms Benign functionality
September 28th, 2010 18 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) -0.14 1.88 -15.04 2 6 0 79 316.086 2
Mid Mid (pH 6-8) 0.04 -0.74 -46.25 1 6 -1 85 315.078 2

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

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