UCSF

ZINC04498998

Substance Information

In ZINC since Heavy atoms Benign functionality
December 5th, 2005 26 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) 2.94 8.37 -16.2 1 7 0 90 371.78 5
Ref Reference (pH 7) 2.94 8.21 -22.62 1 7 0 90 371.78 5

Activity (Go SEA)

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