UCSF

ZINC63958853

Substance Information

In ZINC since Heavy atoms Benign functionality
June 8th, 2011 25 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 0.91 3.9 -61.3 1 8 -1 119 335.347 3
Hi High (pH 8-9.5) 0.73 5.46 -60.96 1 8 -1 111 335.347 3

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

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