UCSF

ZINC49888727

Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2010 44 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) -2.23 -15.95 -24.21 11 17 0 290 626.52 7
Hi High (pH 8-9.5) -2.23 -14.89 -70.82 10 17 -1 292 625.512 7

Activity (Go SEA)

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