UCSF

ZINC33359084

Substance Information

In ZINC since Heavy atoms Benign functionality
July 3rd, 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) 1.70 4.46 -11.01 1 5 0 63 310.419 5
Lo Low (pH 4.5-6) 1.70 4.94 -42.01 2 5 1 64 311.427 5

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

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