UCSF

ZINC24680478

Substance Information

In ZINC since Heavy atoms Benign functionality
January 19th, 2009 25 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) 2.17 6.33 -43.92 3 6 1 76 361.491 8
Hi High (pH 8-9.5) 2.17 4.4 -22.72 2 6 0 74 360.483 8

Activity (Go SEA)

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