UCSF

ZINC39264757

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 28 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) 4.64 12.52 -16.63 3 7 0 88 375.432 8
Lo Low (pH 4.5-6) 4.64 12.9 -41.98 4 7 1 89 376.44 8

Activity (Go SEA)

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