UCSF

ZINC34894329

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2009 15 Yes

Popular Name: [4-[(1R,5S)-3-methyl-3-azabicyclo[3.1.0]hexan-5-yl]phenyl]methanamine [4-[(1R,5S)-3-methyl-3-azabicycl…

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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) 1.66 6.2 -86.61 4 2 2 32 204.317 2 ↓
Hi High (pH 8-9.5) 1.66 5.8 -36.19 3 2 1 30 203.309 2 ↓

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

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