UCSF

ZINC52842174

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2010 29 No

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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) 2.44 8.14 -17.16 1 8 0 88 397.479 5
Mid Mid (pH 6-8) 2.44 8.63 -35.15 2 8 1 89 398.487 5

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

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