UCSF

ZINC04450501

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2005 19 Yes

Popular Name: N-(3,5-dichloro-2-methoxybenzyl)-N-(3-pyridinylmethyl)amine N-(3,5-dichloro-2-methoxybenzyl)…

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Other Names:

MFCD04524285

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) 2.93 6.94 -48.72 2 3 1 39 298.193 5 ↓
Lo Low (pH 4.5-6) 2.93 7.22 -110.72 3 3 2 40 299.201 5 ↓

Activity (Go SEA)

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