UCSF

ZINC40165658

Substance Information

In ZINC since Heavy atoms Benign functionality
April 1st, 2010 12 Yes

Other Names:

F1957-0096

MFCD14704083

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) 2.09 4.46 -23.55 2 2 1 26 163.244 0
Mid Mid (pH 6-8) 2.09 4.09 -5.86 1 2 0 25 162.236 0

Activity (Go SEA)

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