UCSF

ZINC35663663

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 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) 1.47 4.25 -28.01 4 6 1 89 260.321 4
Hi High (pH 8-9.5) 1.47 4.11 -11.75 3 6 0 88 259.313 4

Activity (Go SEA)

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