UCSF

ZINC69975461

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 24 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) -0.50 0.36 -16.34 2 8 0 93 340.424 6
Lo Low (pH 4.5-6) -0.50 2.6 -51.56 3 8 1 94 341.432 6

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

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