UCSF

ZINC36871542

Substance Information

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

Other Names:

MFCD12104714

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) 1.18 5.29 -40.62 3 3 1 48 221.324 5
Hi High (pH 8-9.5) 1.18 4.95 -8.05 2 3 0 46 220.316 5

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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