| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2008 | 21 | Yes |
Popular Name: 3-Azabicyclo[3.1.0]hexan-6-amine, N,N-bis(phenylmethyl)-, (1a,5a,6a)- (9CI) 3-Azabicyclo[3.1.0]hexan-6-amine…
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CAS Numbers: 210482-10-3 , 220158-68-9 , [210482-10-3]
3-Azabicyclo[3.1.0]hexan-6-amine, N,N-bis(phenylmethyl)-, (1a,5a,6a)-(9CI)
AZABICYCLOHEXANAMINEBISPHENYLMETHYLC
| 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) | 3.62 | 8.5 | -28.6 | 2 | 2 | 1 | 20 | 279.407 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.62 | 10.02 | -98.16 | 3 | 2 | 2 | 21 | 280.415 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.62 | 8.58 | -34.08 | 2 | 2 | 1 | 16 | 279.407 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
