UCSF

ZINC33834009

Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 32 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) 1.21 -3.43 -23.83 5 10 0 159 446.408 5
Hi High (pH 8-9.5) 1.21 -2.43 -73.72 4 10 -1 162 445.4 5

Activity (Go SEA)

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