UCSF

ZINC54899010

Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 2010 28 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) 2.73 6.66 -9.63 2 6 0 71 391.418 9
Lo Low (pH 4.5-6) 2.73 7.08 -85.04 3 6 0 72 392.426 9

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

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