UCSF

ZINC18179988

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2008 35 No

Other Names:

MFCD01036982

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) 4.76 14.02 -17.14 0 6 0 81 485.923 2
Ref Reference (pH 7) 4.76 12.69 -10.48 0 6 0 81 485.923 2

Activity (Go SEA)

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

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