UCSF

ZINC49888851

Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2010 44 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) 0.75 -4.23 -24.81 7 15 0 239 620.56 7
Hi High (pH 8-9.5) 0.75 -3.46 -61.17 6 15 -1 242 619.552 7

Activity (Go SEA)

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