UCSF

ZINC26895152

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2009 21 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) 2.72 6.09 -18.02 1 5 0 72 366.192 2
Hi High (pH 8-9.5) 2.72 6.87 -59.62 0 5 -1 75 365.184 2

Activity (Go SEA)

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