UCSF

ZINC45096696

Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2010 18 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) 0.69 3.92 -40.85 3 5 1 63 254.354 6
Hi High (pH 8-9.5) 0.69 2.08 -17.67 2 5 0 61 253.346 6

Activity (Go SEA)

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