UCSF

ZINC00363835

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 12 Yes

Other Names:

MFCD04151187

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) 0.67 -1.75 -13.12 2 4 0 66 187.22 2
Hi High (pH 8-9.5) 0.67 -1.68 -40.66 1 4 -1 68 186.212 2

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks
MP 93 - 95 Enamine Building Blocks
MP 93...95 Enamine Building Blocks
purity 95 Enamine Building Blocks

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