UCSF

ZINC00335029

Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2005 11 Yes

Other Names:

MFCD01860214

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) 1.21 -0.33 -44.93 0 3 -1 53 168.197 2

Vendor Notes

Note Type Comments Provided By
MP 182 - 184 Enamine Building Blocks
MP 182...184 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
PUBCHEM_PATENT_ID EP0163855A1; EP0691971A1; US4678795; US4812571; US5817679; US6060473; US6117889; WO1994022868A1; WO1996006093A1 IBM Patent Data

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