UCSF

ZINC01833277

Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2004 36 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) 2.96 8.95 -22.38 2 9 0 111 486.528 9
Ref Reference (pH 7) 2.96 9.09 -17.57 2 9 0 111 486.528 9

Activity (Go SEA)

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