UCSF

ZINC20120438

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2008 16 Yes

Other Names:

MFCD13813650

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) -0.24 1.79 -50.82 2 7 -1 110 218.196 3

Activity (Go SEA)

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