UCSF

ZINC40659856

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2010 21 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) 2.58 7.58 -21.61 2 7 0 104 300.196 4
Mid Mid (pH 6-8) 3.03 5.14 -41.15 1 7 -1 107 299.188 4

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

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