UCSF

ZINC56894935

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 11th, 2011 16 Yes

Popular Name: 1-cyclopropyl-3-(3-fluorophenyl)piperazine 1-cyclopropyl-3-(3-fluorophenyl)…

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Other Names:

MFCD21091957

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) 2.08 5.31 -39.14 2 2 1 20 221.299 2 ↓
Hi High (pH 8-9.5) 2.08 6.23 -35.13 2 2 1 16 221.299 2 ↓
Hi High (pH 8-9.5) 2.08 4.01 -2.9 1 2 0 15 220.291 2 ↓

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Rings

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

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