UCSF

ZINC17207248

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2008 32 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) 4.62 8.08 -17.3 1 8 0 96 472.592 7
Ref Reference (pH 7) 3.69 7.89 -19.02 1 8 0 93 472.592 8

Activity (Go SEA)

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