UCSF

ZINC01298918

Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2004 36 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) 5.02 12.06 -19.19 2 7 0 93 482.584 8
Ref Reference (pH 7) 5.02 12.19 -14.37 2 7 0 93 482.584 8

Activity (Go SEA)

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