UCSF

ZINC32124775

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2009 28 No

Download: MOL2 SDF SMILES Flexibase

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) 7.90 13.5 -5.03 0 3 0 34 431.388 3
Ref Reference (pH 7) 7.90 14.33 -4.57 0 3 0 34 431.388 3

Activity (Go SEA)

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