UCSF

ZINC14349157

Substance Information

In ZINC since Heavy atoms Benign functionality
July 8th, 2008 23 Yes

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) 3.39 7.28 -10 2 4 0 58 309.344 4
Ref Reference (pH 7) 3.39 7.35 -9.92 2 4 0 58 309.344 4

Activity (Go SEA)

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