UCSF

ZINC12447726

Substance Information

In ZINC since Heavy atoms Benign functionality
May 15th, 2008 20 No

Other Names:

MFCD01304984

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) 3.52 10.34 -12.63 0 3 0 43 263.296 2
Ref Reference (pH 7) 3.52 9.86 -10.5 0 3 0 43 263.296 2

Activity (Go SEA)

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