UCSF

ZINC13127857

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 29th, 2008 32 Yes

Popular Name: 5-(3,4-dimethoxyphenyl)-N-(tetrahydro-2-furanylmethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide 5-(3,4-dimethoxyphenyl)-N-(tetra…

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Other Names:

MFCD02628188

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) 2.14 5.18 -15.41 2 8 0 87 454.449 7 ↓
Mid Mid (pH 6-8) 2.31 5.56 -17.94 2 8 0 90 454.449 7 ↓
Mid Mid (pH 6-8) 2.21 4.23 -41.53 3 8 1 92 455.457 7 ↓

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