UCSF

ZINC34852667

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2009 34 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) 5.26 10.4 -19.12 1 8 0 101 464.47 10
Hi High (pH 8-9.5) 5.26 11.41 -65.78 0 8 -1 103 463.462 10

Activity (Go SEA)

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