UCSF

ZINC19946393

Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 17 Yes

Other Names:

F2146-0083

MFCD10008530

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) 1.90 3.38 -52.63 2 4 1 42 250.347 2
Hi High (pH 8-9.5) 1.90 1.97 -10.76 1 4 0 37 249.339 2

Activity (Go SEA)

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