UCSF

ZINC34006241

Substance Information

In ZINC since Heavy atoms Benign functionality
August 7th, 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) -3.76 5.23 -103.83 1 8 -2 134 233.176 9
Hi High (pH 8-9.5) -3.76 3.16 -186.81 0 8 -3 133 232.168 9

Activity (Go SEA)

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