UCSF

ZINC19735883

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2008 24 Yes

Popular Name: 2-[(4-Benzyl-1-piperazinyl)carbonyl]benzoic acid 2-[(4-Benzyl-1-piperazinyl)carbo…

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CAS Numbers: , 327106-95-6

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) 1.72 8.1 -66.13 0 5 -1 64 323.372 4 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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