UCSF

ZINC36228464

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 13 Yes

Other Names:

MFCD12079609

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) 0.23 3.18 -40.81 2 4 1 44 184.263 6
Hi High (pH 8-9.5) 0.23 1.82 -6.26 1 4 0 39 183.255 6

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% )