UCSF

ZINC38343300

Substance Information

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

Other Names:

MFCD13196541

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) 0.86 2.58 -38.69 3 2 1 31 169.292 2
Mid Mid (pH 6-8) 0.86 4.76 -99.27 4 2 2 32 170.3 2

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% )