UCSF

ZINC11535963

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2008 18 No

Popular Name: (3Z)-3-[[(3R,6S)-2,7,7-trimethyl-3-bicyclo[4.1.0]hept-1-enyl]imino]cyclohexan-1-one (3Z)-3-[[(3R,6S)-2,7,7-trimethyl…

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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) 3.18 8.45 -12.45 1 2 0 29 245.366 2 ↓
Hi High (pH 8-9.5) 3.72 7.57 -42.31 0 2 -1 35 244.358 1 ↓

Activity (Go SEA)

Rings

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