UCSF

ZINC04483870

Substance Information

In ZINC since Heavy atoms Benign functionality
December 4th, 2005 30 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) 3.39 7.51 -21.82 1 8 0 94 405.458 5
Ref Reference (pH 7) 3.39 6.88 -14.58 1 8 0 94 405.458 5
Ref Reference (pH 7) 3.39 6.41 -14.29 1 8 0 94 405.458 5
Ref Reference (pH 7) 3.39 6.37 -12.13 1 8 0 94 405.458 5

Activity (Go SEA)

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