UCSF

ZINC08433402

Substance Information

In ZINC since Heavy atoms Benign functionality
July 14th, 2006 38 No

Other Names:

MFCD03299853

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) 4.68 1.84 -49.85 2 8 1 89 525.666 14
Mid Mid (pH 6-8) 4.09 1.75 -59.73 1 8 1 86 525.666 14

Activity (Go SEA)

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