UCSF

ZINC05525688

Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2006 20 Yes

Other Names:

MFCD01443659

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) 4.37 10.36 -43.55 1 2 1 22 306.838 3
Mid Mid (pH 6-8) 4.37 7.66 -7.4 0 2 0 20 305.83 3

Activity (Go SEA)

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