UCSF

ZINC65344585

Substance Information

In ZINC since Heavy atoms Benign functionality
July 11th, 2011 15 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

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) 0.66 1.2 -16.96 2 5 0 83 222.225 2
Hi High (pH 8-9.5) 1.12 -0.76 -37.68 1 5 -1 86 221.217 2

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

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