UCSF

ZINC37921247

Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2009 20 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) 0.53 2.34 -13.75 2 9 0 134 317.714 5
Hi High (pH 8-9.5) 0.53 2.51 -42.38 1 9 -1 136 316.706 5

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

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