UCSF

ZINC95743546

Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2014 10 Yes

CAS Number: 933-67-5

Other Names:

MFCD00005684

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) 2.03 4.94 -9.75 0 1 0 13 131.178 0

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.