UCSF

ZINC38210768

Substance Information

In ZINC since Heavy atoms Benign functionality
January 12th, 2010 33 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) 2.44 7.47 -14.63 1 8 0 96 450.491 4
Hi High (pH 8-9.5) 2.44 8.48 -58.26 0 8 -1 99 449.483 4

Activity (Go SEA)

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