UCSF

ZINC06015624

Substance Information

In ZINC since Heavy atoms Benign functionality
February 24th, 2006 37 No

Other Names:

MFCD01571917

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 7.01 0.6 -9.78 0 6 0 74 501.623 7
Mid Mid (pH 6-8) 7.19 0.66 -11.46 0 6 0 74 501.623 7

Activity (Go SEA)

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