UCSF

ZINC34622042

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 12 Yes

Other Names:

MFCD12148638

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) 0.16 1.21 -38.03 3 4 1 63 176.236 6
Mid Mid (pH 6-8) 0.16 -0.19 -7 2 4 0 59 175.228 6

Vendor Notes

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

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