UCSF

ZINC66180684

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 20th, 2011 27 Yes

Popular Name: benzenemethanamine, 3-methoxy-4-(2-phenoxyethoxy)-N-(phenylmethyl)- benzenemethanamine, 3-methoxy-4-…

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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) 4.22 11.21 -52.87 2 4 1 44 364.465 10 ↓
Hi High (pH 8-9.5) 4.22 9.85 -10.43 1 4 0 40 363.457 10 ↓

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

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