UCSF

ZINC34317753

Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2009 12 Yes

Other Names:

MFCD14705677

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) 0.41 1.61 -42.61 0 5 -1 67 161.144 1
Mid Mid (pH 6-8) 0.41 2.17 -49.27 1 5 0 68 162.152 1

Vendor Notes

Note Type Comments Provided By
MP 251 - 253 Enamine Building Blocks
MP 251...253 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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

No pre-computed analogs available. Try a structural similarity search.