UCSF

ZINC18008360

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2008 32 No

Other Names:

MFCD03471669

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) 5.93 7.95 -15.32 2 6 0 96 446.528 4
Ref Reference (pH 7) 5.93 8.03 -15.25 2 6 0 96 446.528 4

Activity (Go SEA)

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

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