UCSF

ZINC05496957

Substance Information

In ZINC since Heavy atoms Benign functionality
February 3rd, 2006 15 No

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 1.60 3.23 -5.52 0 4 0 52 230.285 9
Hi High (pH 8-9.5) 1.60 2.27 -46.45 0 4 -1 52 229.277 9

Activity (Go SEA)

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