UCSF

ZINC33696146

Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2009 32 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) 1.65 5.85 -40.57 1 10 -1 145 441.416 10
Lo Low (pH 4.5-6) 1.65 4.73 -22.76 2 10 0 142 442.424 10

Activity (Go SEA)

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