UCSF

ZINC04889084

Substance Information

In ZINC since Heavy atoms Benign functionality
January 9th, 2006 22 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) 1.24 5.06 -14.66 1 7 0 88 301.302 4
Ref Reference (pH 7) 1.24 5.04 -9.19 1 7 0 88 301.302 4
Ref Reference (pH 7) 1.24 5.06 -14.74 1 7 0 88 301.302 4
Ref Reference (pH 7) 1.24 5.03 -9.14 1 7 0 88 301.302 4

Activity (Go SEA)

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