UCSF

ZINC38590032

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 27 Yes

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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) 3.99 9.74 -50.37 2 5 1 50 384.887 5
Mid Mid (pH 6-8) 3.99 7.53 -9.32 1 5 0 49 383.879 5

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

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