UCSF

ZINC24978028

Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2009 21 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) 2.94 6.99 -8.31 0 5 0 43 280.331 2
Lo Low (pH 4.5-6) 2.94 7.26 -42.64 1 5 1 44 281.339 2

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

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