UCSF

ZINC26143752

Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2009 37 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) -1.56 3.85 -62.82 4 15 -1 218 553.534 9
Hi High (pH 8-9.5) -1.10 3.06 -116.43 3 15 -2 221 552.526 9

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

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