UCSF

ZINC25052794

Substance Information

In ZINC since Heavy atoms Benign functionality
January 24th, 2009 31 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) 2.57 2.73 -22.72 1 8 0 119 495.007 5
Hi High (pH 8-9.5) 3.03 1.72 -50.56 0 8 -1 122 493.999 5

Activity (Go SEA)

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