UCSF

ZINC08383799

Substance Information

In ZINC since Heavy atoms Benign functionality
July 12th, 2006 44 No

Other Names:

MFCD04088654

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) 3.27 -0.99 -62.66 2 10 1 108 601.676 11
Mid Mid (pH 6-8) 2.69 -1.07 -73.78 1 10 1 105 601.676 11

Activity (Go SEA)

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