UCSF

ZINC00001651

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 21 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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) 3.83 12.26 -40.98 1 2 1 9 277.391 2
Mid Mid (pH 6-8) 3.83 9.88 -6.72 0 2 0 8 276.383 2

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks
MP 94 - 96 Enamine Building Blocks
MP 94...96 Enamine Building Blocks
purity 95 Enamine Building Blocks
Therapy H1 antihistamine SMDC MicroSource

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Analogs ( Draw Identity 99% 90% 80% 70% )