UCSF

ZINC13617327

Substance Information

In ZINC since Heavy atoms Benign functionality
June 22nd, 2008 29 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) 3.62 6.24 -11.78 2 6 0 90 489.372 2
Ref Reference (pH 7) 3.62 6.3 -12.99 2 6 0 90 489.372 2

Activity (Go SEA)

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