UCSF

ZINC06209918

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2006 24 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) 5.96 10.76 -7.78 1 3 0 53 359.256 4
Mid Mid (pH 6-8) 6.15 9.3 -41.79 0 3 -1 59 358.248 4

Activity (Go SEA)

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