UCSF

ZINC02088456

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 28 Yes

Popular Name: 5-(4-bromophenyl)-N-butyl-3-chloro-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide 5-(4-bromophenyl)-N-butyl-3-chlo…

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Other Names:

MFCD02056284

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) 5.28 8.83 -11.24 2 5 0 59 479.728 6 ↓
Mid Mid (pH 6-8) 5.46 9.26 -37.1 3 5 1 64 480.736 6 ↓

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

No pre-computed analogs available. Try a structural similarity search.