UCSF

ZINC07165236

Substance Information

In ZINC since Heavy atoms Benign functionality
May 21st, 2006 25 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) 4.19 6.91 -9.4 2 5 0 82 377.227 5
Hi High (pH 8-9.5) 4.37 5.24 -36.54 1 5 -1 89 376.219 5

Activity (Go SEA)

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