UCSF

ZINC36378401

Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2009 16 Yes

Other Names:

MFCD09810914

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) 0.62 4.14 -95.19 4 3 2 35 221.348 3
Mid Mid (pH 6-8) 0.62 1.77 -42.53 3 3 1 34 220.34 3

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% )