UCSF

ZINC16874629

Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2008 24 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

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) 2.04 10.28 -42.21 2 6 1 56 352.459 6
Mid Mid (pH 6-8) 2.04 7.85 -20.55 1 6 0 55 351.451 6

Activity (Go SEA)

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