UCSF

ZINC06499093

Substance Information

In ZINC since Heavy atoms Benign functionality
April 3rd, 2006 33 No

Other Names:

MFCD03501517

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) 0.66 5.45 -54.71 2 9 1 103 454.503 8
Mid Mid (pH 6-8) 0.08 6.12 -64.3 1 9 1 99 454.503 8

Activity (Go SEA)

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