UCSF

ZINC26150133

Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2009 14 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) -3.04 -1.01 -67.48 4 6 -1 128 222.157 2
Mid Mid (pH 6-8) -3.04 0.15 -150.64 3 6 -2 131 221.149 2

Activity (Go SEA)

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