UCSF

ZINC22075172

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2008 25 Yes

Popular Name: N'-(2-Benzyloxy-3-methoxy-benzyl)-N,N-diethyl-ethane-1,2-diamine N'-(2-Benzyloxy-3-methoxy-benzyl…

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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) 3.69 9.06 -41.63 2 4 1 38 343.491 11 ↓
Mid Mid (pH 6-8) 3.69 9.77 -36.19 2 4 1 35 343.491 11 ↓

Activity (Go SEA)

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