UCSF

ZINC05941634

Substance Information

In ZINC since Heavy atoms Benign functionality
February 19th, 2006 15 No

Other Names:

MFCD03420654

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) 2.50 6.53 -39.59 0 3 -1 53 219.138 3
Mid Mid (pH 6-8) 1.31 6.57 -10.15 0 3 0 47 220.146 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% )