UCSF

ZINC17146075

Substance Information

In ZINC since Heavy atoms Benign functionality
September 16th, 2008 29 No

Other Names:

MFCD02951133

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) 5.93 10.32 -8.44 0 5 0 53 408.523 5
Ref Reference (pH 7) 5.93 11.72 -9.24 0 5 0 53 408.523 5

Activity (Go SEA)

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