UCSF

ZINC36104730

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 28 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 4.00 10.86 -41.37 1 8 0 104 401.492 5
Hi High (pH 8-9.5) 4.00 8.93 -45.23 0 8 -1 102 400.484 5

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

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