UCSF

ZINC41841617

Substance Information

In ZINC since Heavy atoms Benign functionality
April 23rd, 2010 15 Yes

Other Names:

MFCD20502150

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) -1.03 4.71 -30.74 1 4 0 48 212.293 2
Hi High (pH 8-9.5) -1.03 2.64 -47.6 0 4 -1 47 211.285 2

Vendor Notes

Note Type Comments Provided By
MP 249 - 251 Enamine Building Blocks
MP 249...251 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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