UCSF

ZINC37022691

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2009 16 Yes

Other Names:

MFCD11618599

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) 2.79 5.24 -11.28 1 3 0 41 219.284 2
Hi High (pH 8-9.5) 2.79 6.17 -56.51 0 3 -1 43 218.276 2

Vendor Notes

Note Type Comments Provided By
MP 65 - 74 Enamine Building Blocks
MP 65...74 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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