UCSF

ZINC05445230

Substance Information

In ZINC since Heavy atoms Benign functionality
February 2nd, 2006 28 No

Other Names:

MFCD02048184

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.86 2.39 -44.58 2 6 1 71 381.452 6
Mid Mid (pH 6-8) 1.83 2.21 -44.89 1 6 1 68 381.452 7

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

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