UCSF

ZINC34894433

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2009 17 No

Popular Name: (1R,5S)-5-(3-chloro-4-nitro-phenyl)-3-methyl-3-azabicyclo[3.1.0]hexane (1R,5S)-5-(3-chloro-4-nitro-phen…

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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) 3.05 9.26 -48.56 1 4 1 50 253.709 2 ↓
Hi High (pH 8-9.5) 3.05 6.7 -6.31 0 4 0 49 252.701 2 ↓

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

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