UCSF

ZINC95743573

Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2014 9 Yes

CAS Numbers: 120-73-0 , 51953-03-8

Other Names:

MFCD00079221

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) -0.48 -0.48 -8.79 0 4 0 49 120.115 0

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.