UCSF

ZINC06556531

Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2006 16 Yes

Other Names:

MFCD03230567

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) 2.53 6.52 -47.81 0 3 -1 53 233.268 2
Mid Mid (pH 6-8) 2.53 5.85 -13.33 1 3 0 50 234.276 2

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

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