UCSF

ZINC19796178

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2008 13 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) -2.65 1.17 -72.94 6 5 1 108 206.291 6
Hi High (pH 8-9.5) -2.65 0.82 -57.14 5 5 0 106 205.283 6

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

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