UCSF

ZINC09233133

Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2007 39 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) 5.45 12.89 -12.17 0 8 0 78 530.621 11
Ref Reference (pH 7) 5.45 13.28 -13.92 0 8 0 78 530.621 11

Activity (Go SEA)

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