UCSF

ZINC62526891

Substance Information

In ZINC since Heavy atoms Benign functionality
May 2nd, 2011 29 Yes

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) 3.27 11.07 -42.54 1 5 1 37 392.523 4
Hi High (pH 8-9.5) 3.27 8.47 -11.69 0 5 0 36 391.515 4

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

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