UCSF

ZINC07158832

Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2006 27 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) 4.42 7.9 -11.44 2 5 0 82 356.381 5
Hi High (pH 8-9.5) 4.60 6.19 -51.45 1 5 -1 89 355.373 5

Activity (Go SEA)

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