UCSF

ZINC36092207

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 11 Yes

Other Names:

MFCD11934396

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) -0.63 -0.39 -39.83 3 3 1 40 157.237 1
Lo Low (pH 4.5-6) -0.63 1.58 -100.95 4 3 2 41 158.245 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% )