UCSF

ZINC06077254

Substance Information

In ZINC since Heavy atoms Benign functionality
March 4th, 2006 36 No

Other Names:

MFCD00771574

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) 7.00 0.34 -8.05 0 5 0 58 484.64 6
Lo Low (pH 4.5-6) 7.18 0.4 -9.31 0 5 0 58 484.64 6

Activity (Go SEA)

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