UCSF

ZINC06635393

Substance Information

In ZINC since Heavy atoms Benign functionality
April 11th, 2006 27 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) 5.26 9.08 -15.13 2 6 0 84 365.433 6
Hi High (pH 8-9.5) 5.26 10.09 -62.8 1 6 -1 87 364.425 6

Activity (Go SEA)

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