UCSF

ZINC25179943

Substance Information

In ZINC since Heavy atoms Benign functionality
January 25th, 2009 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) 2.03 6.42 -74.08 3 8 0 124 458.898 10
Hi High (pH 8-9.5) 2.03 4.93 -55.6 2 8 -1 119 457.89 10

Activity (Go SEA)

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