UCSF

ZINC04807665

Substance Information

In ZINC since Heavy atoms Benign functionality
January 5th, 2006 26 Yes

Download: MOL2 SDF SMILES Flexibase

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) 1.65 -0.86 -52.66 2 7 1 80 360.434 6

Activity (Go SEA)

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