UCSF

ZINC49569646

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 15 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) 1.26 6.04 -81.97 3 3 2 30 227.377 2
Hi High (pH 8-9.5) 1.26 3.61 -26.79 2 3 1 29 226.369 2

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

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