UCSF

ZINC17987174

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2008 29 No

Other Names:

MFCD02871171

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) 5.83 13.09 -12.56 0 5 0 64 432.303 4
Ref Reference (pH 7) 5.83 12.84 -11.6 0 5 0 64 432.303 4

Activity (Go SEA)

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

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