UCSF

ZINC00050819

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2005 16 Yes

Popular Name: "3-((Piperidin-1-yl)methyl)-1H-indole, 98%" "3-((Piperidin-1-yl)methyl)-1H-i…

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CAS Number: 5355-42-0

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) 2.80 8.34 -34.55 2 2 1 20 215.32 2 ↓
Hi High (pH 8-9.5) 2.80 6.12 -4.64 1 2 0 19 214.312 2 ↓

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