UCSF

ZINC63941670

Substance Information

In ZINC since Heavy atoms Benign functionality
June 8th, 2011 23 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) -0.01 3.89 -51.77 3 9 1 116 319.297 5
Hi High (pH 8-9.5) -0.01 2.33 -20.8 2 9 0 115 318.289 5

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

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