UCSF

ZINC08742593

Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2007 23 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) 3.07 5.11 -46.68 0 5 -1 75 325.369 3
Ref Reference (pH 7) 3.07 5.18 -45.78 0 5 -1 75 325.369 3

Activity (Go SEA)

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