UCSF

ZINC38971041

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 2nd, 2010 15 Yes

Popular Name: 2,6-dimethyl-1-(2-piperidinylmethyl)piperidine 2,6-dimethyl-1-(2-piperidinylmet…

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CAS Number: 1005116-45-9

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) 2.59 7.29 -106.57 3 2 2 21 212.381 2 ↓
Hi High (pH 8-9.5) 2.59 5.57 -31.94 2 2 1 20 211.373 2 ↓
Mid Mid (pH 6-8) 2.59 6.02 -27.59 2 2 1 16 211.373 2 ↓

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