UCSF

ZINC65499613

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 22 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) 3.15 2.97 -10.39 1 5 0 49 318.808 4
Lo Low (pH 4.5-6) 3.15 3.98 -42.89 2 5 1 51 319.816 4

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

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