UCSF

ZINC23039476

Substance Information

In ZINC since Heavy atoms Benign functionality
December 24th, 2008 26 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) 4.11 8.93 -39.29 3 5 1 63 374.892 7
Hi High (pH 8-9.5) 4.11 6.89 -8.6 2 5 0 61 373.884 7

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

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