UCSF

ZINC12412076

Substance Information

In ZINC since Heavy atoms Benign functionality
May 14th, 2008 28 No

Other Names:

MFCD02944412

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) 3.53 9.36 -11.99 1 6 0 71 397.5 6
Ref Reference (pH 7) 3.53 8.83 -12.19 1 6 0 71 397.5 6

Activity (Go SEA)

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