UCSF

ZINC38545641

Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2010 12 Yes

CAS Number: 23662-75-1

Other Names:

MFCD00800214

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) -0.87 0.09 -35.55 1 6 -1 92 162.132 0

Activity (Go SEA)

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