UCSF

ZINC39551675

Substance Information

In ZINC since Heavy atoms Benign functionality
February 28th, 2010 33 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) 3.73 14.66 -79.36 2 6 1 61 449.619 5
Hi High (pH 8-9.5) 3.73 12.44 -22.57 1 6 0 60 448.611 5

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