UCSF

ZINC38343409

Substance Information

In ZINC since Heavy atoms Benign functionality
January 15th, 2010 12 Yes

Other Names:

MFCD13196466

MFCD13196557

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) 0.65 4.05 -26.38 2 2 1 16 167.276 1
Lo Low (pH 4.5-6) 0.65 5.35 -99.02 3 2 2 21 168.284 1

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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