UCSF

ZINC06149860

Substance Information

In ZINC since Heavy atoms Benign functionality
March 8th, 2006 41 No

Other Names:

MFCD02232139

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) 6.60 2.16 -14.12 0 8 0 92 563.691 13
Mid Mid (pH 6-8) 6.60 1.98 -17.88 0 8 0 92 563.691 13
Mid Mid (pH 6-8) 6.78 1.06 -15.72 0 8 0 92 563.691 13

Activity (Go SEA)

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