UCSF

ZINC67117636

Substance Information

In ZINC since Heavy atoms Benign functionality
September 5th, 2011 24 No

Download: MOL2 SDF SMILES Flexibase

Annotations

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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) 1.17 6.49 -58.21 3 7 1 83 357.5 6
Mid Mid (pH 6-8) 1.17 4.68 -29.45 2 7 0 82 356.492 6

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

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