UCSF

ZINC33833250

Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 35 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) -0.35 -8.61 -31.72 8 13 0 220 494.405 5
Hi High (pH 8-9.5) -0.35 -7.82 -88.03 7 13 -1 223 493.397 5

Activity (Go SEA)

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