UCSF

ZINC19288369

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2008 24 No

Download: MOL2 SDF SMILES Flexibase

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) 0.51 0.03 -17.32 1 8 0 100 334.376 1
Mid Mid (pH 6-8) 0.51 2.27 -44.92 2 8 1 102 335.384 1

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

No pre-computed analogs available. Try a structural similarity search.