UCSF

ZINC06624020

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2006 21 Yes

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) 0.14 4.96 -49.57 2 6 -1 98 282.279 3
Mid Mid (pH 6-8) 0.14 5.4 -49.46 3 6 0 99 283.287 3

Activity (Go SEA)

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