UCSF

ZINC17127788

Substance Information

In ZINC since Heavy atoms Benign functionality
September 15th, 2008 20 No

Download: MOL2 SDF SMILES Flexibase

Annotations

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Vendors

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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) 1.65 3.42 -10.63 2 6 0 76 298.364 3
Lo Low (pH 4.5-6) 1.65 3.87 -38.47 3 6 1 77 299.372 3

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

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