UCSF

ZINC05847261

Substance Information

In ZINC since Heavy atoms Benign functionality
February 17th, 2006 15 Yes

CAS Number: N/A

Other Names:

MFCD11896621

N/A

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) 1.72 -5.31 -13.65 3 4 0 71 221.285 0

Activity (Go SEA)

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