UCSF

ZINC26841206

Substance Information

In ZINC since Heavy atoms Benign functionality
February 10th, 2009 33 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) 1.35 12.4 -80.03 1 9 0 104 487.607 6
Mid Mid (pH 6-8) 1.35 10.03 -61.8 0 9 -1 103 486.599 6

Activity (Go SEA)

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