UCSF

ZINC38342015

Substance Information

In ZINC since Heavy atoms Benign functionality
January 15th, 2010 13 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) 0.03 0.31 -98.21 4 5 2 71 186.259 3
Hi High (pH 8-9.5) 0.03 0.06 -39.73 3 5 1 69 185.251 3

Vendor Notes

Note Type Comments Provided By
MP 201 - 203 Enamine Building Blocks
MP 201...203 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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