UCSF

ZINC02539206

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 18 No

CAS Numbers: 1163303-84-1 , 60280-45-7

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) 0.38 -3.99 -62.2 1 7 -1 112 280.322 7

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
MP 99 - 101 Enamine Building Blocks
MP 99...101 Enamine Building Blocks

Activity (Go SEA)

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