UCSF

ZINC30545140

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 30th, 2009 31 Yes

Popular Name: (1S)-1-(4-methoxyphenyl)-N'-[[3-methoxy-4-(4-pyridylmethoxy)phenyl]methyl]-N,N-dimethyl-ethane-1,2-d (1S)-1-(4-methoxyphenyl)-N'-[[3-…

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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) 3.12 9.8 -48.89 2 6 1 57 422.549 11 ↓
Lo Low (pH 4.5-6) 3.12 11.15 -142.77 3 6 2 62 423.557 11 ↓

Activity (Go SEA)

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