UCSF

ZINC38740681

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2010 29 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) 2.37 8.98 -46.22 1 9 -1 126 408.419 4
Mid Mid (pH 6-8) 1.91 10.42 -18.02 2 9 0 123 409.427 4

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

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