UCSF

ZINC06197546

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2006 36 No

Other Names:

MFCD02731941

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) 6.04 2.69 -10.89 0 6 0 74 493.575 8
Mid Mid (pH 6-8) 6.04 2.43 -14.62 0 6 0 74 493.575 8
Mid Mid (pH 6-8) 6.23 1.51 -12.85 0 6 0 74 493.575 8

Activity (Go SEA)

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