UCSF

ZINC47225951

Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2010 19 No

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Annotations

Vendors

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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) 2.09 7.95 -10.49 1 4 0 45 257.337 4
Lo Low (pH 4.5-6) 2.09 7.99 -29.2 2 4 1 46 258.345 4

Activity (Go SEA)

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