UCSF

ZINC52899728

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2010 19 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) 3.10 4.86 -11.57 1 4 0 63 291.401 3
Mid Mid (pH 6-8) 3.37 5.37 -8.41 2 4 0 65 291.401 3

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

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