UCSF

ZINC05606662

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2006 13 Yes

Other Names:

MFCD00159709

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) 2.41 6.28 -8.08 1 2 0 29 170.215 2
Mid Mid (pH 6-8) 2.41 6.72 -31.88 2 2 1 30 171.223 2

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

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