UCSF

ZINC01565667

Substance Information

In ZINC since Heavy atoms Benign functionality
December 15th, 2005 38 No

Download: MOL2 SDF SMILES Flexibase

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) 5.86 -0.11 -17.39 1 8 0 91 511.578 11
Lo Low (pH 4.5-6) 5.86 0.16 -43.51 2 8 1 92 512.586 11

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

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