UCSF

ZINC05940911

Substance Information

In ZINC since Heavy atoms Benign functionality
February 19th, 2006 25 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) 1.93 -6.43 -20.02 1 9 0 129 385.423 6
Hi High (pH 8-9.5) 1.93 -5.92 -52.87 0 9 -1 131 384.415 6

Activity (Go SEA)

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