UCSF

ZINC05046401

Substance Information

In ZINC since Heavy atoms Benign functionality
January 18th, 2006 12 Yes

Other Names:

MFCD06655969

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) -0.75 3.23 -11.92 1 4 0 55 169.18 1
Ref Reference (pH 7) -0.75 2.97 -13.82 1 4 0 55 169.18 1

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

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