UCSF

ZINC09418699

Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2007 22 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) -0.26 -0.12 -12.65 3 7 0 99 325.752 5
Ref Reference (pH 7) -0.26 -0.13 -13.03 3 7 0 99 325.752 5

Activity (Go SEA)

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