UCSF

ZINC37857907

Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2009 33 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) 5.57 11.42 -40.15 2 6 1 73 472.989 7
Mid Mid (pH 6-8) 5.57 12 -26.48 1 6 0 76 471.981 7

Activity (Go SEA)

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