UCSF

ZINC06267398

Substance Information

In ZINC since Heavy atoms Benign functionality
March 17th, 2006 29 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) 3.90 12.84 -65.1 2 5 1 38 414.595 8
Hi High (pH 8-9.5) 3.90 10.44 -15.45 1 5 0 37 413.587 8

Activity (Go SEA)

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