UCSF

ZINC40336390

Substance Information

In ZINC since Heavy atoms Benign functionality
April 6th, 2010 30 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) 3.41 14.13 -42.25 2 6 1 68 398.49 6
Mid Mid (pH 6-8) 3.41 13.62 -18.14 1 6 0 67 397.482 6

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

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