UCSF

ZINC06926378

Substance Information

In ZINC since Heavy atoms Benign functionality
May 2nd, 2006 25 No

Download: MOL2 SDF SMILES Flexibase

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) 3.24 6.16 -7.92 1 4 0 55 390.848 1
Mid Mid (pH 6-8) 3.24 6.95 -35.51 0 4 -1 58 389.84 1

Activity (Go SEA)

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