UCSF

ZINC03941049

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 21st, 2005 36 Yes

Popular Name: 3-(3-pyridyl)-N-[4-(4-BLAHylidene-1-piperidyl)butyl]propanamide 3-(3-pyridyl)-N-[4-(4-BLAHyliden…

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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) 5.04 15.97 -49.27 2 4 1 46 498.716 8 ↓
Lo Low (pH 4.5-6) 5.04 16.43 -88.91 3 4 2 48 499.724 8 ↓

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