UCSF

ZINC23363655

Substance Information

In ZINC since Heavy atoms Benign functionality
December 30th, 2008 18 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) 1.27 4.95 -18.13 1 6 0 73 265.342 5
Mid Mid (pH 6-8) 1.34 3.92 -46.64 0 6 -1 79 264.334 5

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

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