UCSF

ZINC22717900

Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2008 33 No

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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) 5.21 12.42 -103.34 0 7 -2 111 478.913 5
Lo Low (pH 4.5-6) 4.75 13.49 -57.42 1 7 -1 108 479.921 5

Activity (Go SEA)

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