UCSF

ZINC65504025

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 24 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) 3.31 10.17 -87.9 4 5 2 59 337.349 5
Mid Mid (pH 6-8) 3.31 9.69 -25.66 3 5 1 58 336.341 5

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

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