UCSF

ZINC04950658

Substance Information

In ZINC since Heavy atoms Benign functionality
January 12th, 2006 22 No

Other Names:

MFCD02107756

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) 1.48 7.08 -49.58 2 5 1 62 323.8 5
Mid Mid (pH 6-8) 0.90 7.95 -62.46 1 5 1 59 323.8 5

Activity (Go SEA)

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