UCSF

ZINC34994653

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2009 19 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) 2.06 7.78 -52.27 2 5 1 75 258.301 5
Hi High (pH 8-9.5) 2.06 6.41 -9.13 1 5 0 71 257.293 5

Activity (Go SEA)

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