UCSF

ZINC34936037

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 17 Yes

Other Names:

MFCD16631694

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) 2.69 6.71 -49.51 2 3 1 33 248.375 1
Hi High (pH 8-9.5) 2.69 5.41 -7.43 1 3 0 28 247.367 1

Activity (Go SEA)

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