UCSF

ZINC37279955

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 23rd, 2009 20 Yes

Popular Name: 1-[5-[[(1S,5R,6R)-6-bicyclo[3.2.0]hept-3-enyl]amino]indolin-1-yl]ethanone 1-[5-[[(1S,5R,6R)-6-bicyclo[3.2.…

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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) 3.40 8.14 -8.05 1 3 0 32 268.36 2 ↓
Lo Low (pH 4.5-6) 3.40 8.83 -41.66 2 3 1 37 269.368 2 ↓

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Rings

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

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