UCSF

ZINC12017306

Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2008 31 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) 4.74 11.35 -8.21 0 6 0 59 434.879 4
Ref Reference (pH 7) 4.74 11.28 -12.66 0 6 0 59 434.879 4

Activity (Go SEA)

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