UCSF

ZINC36886591

Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2009 17 Yes

Other Names:

MFCD11038744

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) 2.15 8.3 -41.41 1 3 1 31 234.298 2
Mid Mid (pH 6-8) 2.15 6.09 -5.15 0 3 0 30 233.29 2

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% )