UCSF

ZINC36222246

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 17 Yes

Other Names:

MFCD14540403

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) 3.34 8.16 -8.23 2 3 0 43 288.148 1
Lo Low (pH 4.5-6) 3.34 8.57 -25.84 3 3 1 45 289.156 1

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% )