UCSF

ZINC38139092

Substance Information

In ZINC since Heavy atoms Benign functionality
January 4th, 2010 38 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) 1.90 5.7 -55.05 4 11 1 144 564.71 9
Mid Mid (pH 6-8) 1.90 3.42 -20.26 3 11 0 142 563.702 9

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

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