UCSF

ZINC83309561

Substance Information

In ZINC since Heavy atoms Benign functionality
January 15th, 2013 29 No

Other Names:

MFCD02146682

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) 3.21 7.19 -13.13 1 7 0 80 413.499 6
Lo Low (pH 4.5-6) -0.46 8 -37.72 2 7 1 80 414.507 7

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

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