UCSF

ZINC00747367

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 38 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 3.35 8.12 -20.8 2 8 0 83 514.626 8
Mid Mid (pH 6-8) 3.35 10.47 -48.19 3 8 1 84 515.634 8

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

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