UCSF

ZINC66074028

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 19th, 2011 17 Yes

Popular Name: 2-[2-(3-pyridyl)ethyl]-1H-indole 2-[2-(3-pyridyl)ethyl]-1H-indole

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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) 3.15 7.87 -7.34 1 2 0 29 222.291 3 ↓
Lo Low (pH 4.5-6) 3.15 8.33 -37.77 2 2 1 30 223.299 3 ↓

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

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