UCSF

ZINC35459041

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2009 34 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) 0.17 -6.24 -19.47 7 12 0 200 478.406 5
Hi High (pH 8-9.5) 0.17 -5.25 -63 6 12 -1 202 477.398 5

Activity (Go SEA)

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