UCSF

ZINC36106547

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 27 Yes

Popular Name: N-[(1S)-2-(4-benzylpiperazin-1-yl)-1-methyl-2-oxo-ethyl]-3-chloro-benzamide N-[(1S)-2-(4-benzylpiperazin-1-y…

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Vendors

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) 2.76 7.53 -9.54 1 5 0 53 385.895 5 ↓
Mid Mid (pH 6-8) 2.76 9.74 -49.52 2 5 1 54 386.903 5 ↓

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

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