UCSF

ZINC08410037

Substance Information

In ZINC since Heavy atoms Benign functionality
July 14th, 2006 34 No

Other Names:

MFCD02946674

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) 4.40 -13.63 -10.13 0 8 0 102 499.354 9
Mid Mid (pH 6-8) 4.40 -9.74 -100.61 2 8 2 105 501.37 9

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.