UCSF

ZINC14555273

Substance Information

In ZINC since Heavy atoms Benign functionality
July 11th, 2008 39 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) 7.78 17.1 -12.96 1 6 0 90 540.741 13
Mid Mid (pH 6-8) 7.19 17.8 -22.82 0 6 0 87 540.741 13

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

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