UCSF

ZINC52480230

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2010 16 No

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Annotations

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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) 0.62 3.31 -139.42 3 4 2 55 248.392 5
Mid Mid (pH 6-8) 0.62 1.75 -51.24 2 4 1 54 247.384 5

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

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