UCSF

ZINC05973590

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 21st, 2006 13 Yes

Popular Name: N-(2-methylbenzyl)-1-butanamine N-(2-methylbenzyl)-1-butanamine

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CAS Number: 60509-42-4

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) 3.33 0.63 -37.87 2 1 1 16 178.299 5 ↓

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