UCSF

ZINC05880166

Substance Information

In ZINC since Heavy atoms Benign functionality
February 18th, 2006 27 Yes

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) 4.56 9.04 -14.13 2 5 0 67 357.413 5
Lo Low (pH 4.5-6) 4.56 9.47 -35.7 3 5 1 68 358.421 5

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

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