UCSF

ZINC37812214

Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2009 19 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) 1.71 6.09 -37.46 2 4 1 37 288.481 8
Mid Mid (pH 6-8) 1.71 7.45 -102.37 3 4 2 41 289.489 8

Activity (Go SEA)

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