UCSF

ZINC06786496

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2006 30 No

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) 2.38 6.48 -62.14 1 8 -1 116 410.402 7
Mid Mid (pH 6-8) 1.35 7.29 -55.03 0 8 -1 113 410.402 8

Activity (Go SEA)

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