UCSF

ZINC02088184

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 30 Yes

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

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Other Names:

MFCD01923095

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) 5.75 9.25 -12.76 2 5 0 59 505.766 4 ↓
Mid Mid (pH 6-8) 5.82 6.4 -13.21 2 5 0 62 505.766 4 ↓
Mid Mid (pH 6-8) 5.92 9.77 -35.23 3 5 1 64 506.774 4 ↓

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

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