UCSF

ZINC06573660

Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2006 29 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 5.88 11.45 -19.14 1 5 0 75 427.287 6
Hi High (pH 8-9.5) 6.07 9.59 -51.02 0 5 -1 82 426.279 6

Activity (Go SEA)

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