UCSF

ZINC35698578

Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2009 16 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) -0.09 3.07 -17.84 2 5 0 67 255.324 2
Mid Mid (pH 6-8) 0.36 1.7 -50.09 1 5 -1 70 254.316 2

Activity (Go SEA)

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