UCSF

ZINC33359171

Substance Information

In ZINC since Heavy atoms Benign functionality
July 3rd, 2009 21 Yes

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) 2.55 6.2 -11.19 0 4 0 43 276.343 2
Lo Low (pH 4.5-6) 2.55 7.09 -38.48 1 4 1 45 277.351 2

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

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