UCSF

ZINC02088898

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 32 Yes

Other Names:

MFCD01531557

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) 5.95 12.06 -36.25 2 6 1 83 431.443 6
Ref Reference (pH 7) 5.95 10.2 -40.87 2 6 1 83 431.443 6

Activity (Go SEA)

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

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