UCSF

ZINC04027113

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2005 11 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) 0.74 2.26 -38.23 2 3 1 37 155.221 0
Hi High (pH 8-9.5) 0.74 -0.07 -4 1 3 0 36 154.213 0

Activity (Go SEA)

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