UCSF

ZINC21527791

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2008 33 Yes

Popular Name: (3S)-N-[3-[4-(1-piperidyl)-1-piperidyl]propyl]-1-(1-piperidylsulfonyl)piperidine-3-carboxamide (3S)-N-[3-[4-(1-piperidyl)-1-pip…

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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) 2.14 7.05 -50.42 2 8 1 77 484.731 8 ↓
Lo Low (pH 4.5-6) 2.14 9.33 -127.22 3 8 2 79 485.739 8 ↓
Lo Low (pH 4.5-6) 2.14 7.09 -58.46 2 8 1 77 484.731 8 ↓

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