UCSF

ZINC70325702

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2011 21 Yes

Popular Name: N-benzyl-N'-[(1R,3S)-3-methoxycyclohexyl]-N-methyl-propane-1,3-diamine N-benzyl-N'-[(1R,3S)-3-methoxycy…

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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) 2.93 6.97 -41.4 2 3 1 29 291.459 8 ↓
Mid Mid (pH 6-8) 2.93 9.28 -111.85 3 3 2 30 292.467 8 ↓

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

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