UCSF

ZINC19958705

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2008 12 Yes

Other Names:

MFCD11146370

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) 1.85 6.07 -96.86 3 2 2 21 174.332 6
Mid Mid (pH 6-8) 1.85 3.68 -34.54 2 2 1 20 173.324 6

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% )