UCSF

ZINC08441174

Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2006 41 No

Other Names:

MFCD04147942

Download: MOL2 SDF SMILES Flexibase

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) 5.70 0.1 -13.54 1 8 0 109 564.619 8
Mid Mid (pH 6-8) 5.12 -0.08 -15.27 0 8 0 106 564.619 8

Activity (Go SEA)

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