UCSF

ZINC37197318

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 19 Yes

Popular Name: N-[(1S,5R,6S)-6-bicyclo[3.2.0]hept-3-enyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine N-[(1S,5R,6S)-6-bicyclo[3.2.0]he…

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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) 3.75 7.05 -5.73 1 3 0 30 257.333 2 ↓
Lo Low (pH 4.5-6) 3.75 7.5 -40.61 2 3 1 35 258.341 2 ↓

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Rings

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

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