UCSF

ZINC37670563

Substance Information

In ZINC since Heavy atoms Benign functionality
November 29th, 2009 13 Yes

Other Names:

MFCD12763555

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) 0.81 4.36 -29.77 2 4 1 52 181.215 4
Mid Mid (pH 6-8) 0.81 3.91 -8.73 1 4 0 51 180.207 4

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% )