UCSF

ZINC00360549

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 14th, 2005 18 Yes

Popular Name: N-(4-ethoxybenzyl)-N-(2-pyridinylmethyl)amine N-(4-ethoxybenzyl)-N-(2-pyridiny…

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Other Names:

MFCD05740315

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) 2.16 -0.74 -43.26 2 3 1 38 243.33 6 ↓
Lo Low (pH 4.5-6) 2.16 -0.68 -114.44 3 3 2 39 244.338 6 ↓

Activity (Go SEA)

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