UCSF

ZINC28086303

Substance Information

In ZINC since Heavy atoms Benign functionality
February 24th, 2009 42 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) -5.45 -2.26 -191.45 16 17 2 312 600.722 19
Hi High (pH 8-9.5) -5.45 -3.52 -135.25 15 17 1 311 599.714 19

Activity (Go SEA)

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