UCSF

ZINC42459110

Substance Information

In ZINC since Heavy atoms Benign functionality
April 29th, 2010 13 Yes

Other Names:

MFCD14664444

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) 0.78 2.51 -25.56 3 4 1 53 182.247 4
Mid Mid (pH 6-8) 0.78 1.99 -6.65 2 4 0 51 181.239 4

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% )