UCSF

ZINC01654190

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 15 Yes

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) 1.71 6.11 -52.1 0 3 -1 53 200.217 3
Lo Low (pH 4.5-6) 1.71 6.36 -47.26 1 3 0 54 201.225 3

Vendor Notes

Note Type Comments Provided By
MP 107 - 109 Enamine Building Blocks
MP 107...109 Enamine Building Blocks
MP 126 - 128 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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