In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 12 | Yes |
Popular Name: 2-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine 2-methyl-3-(4-methylpiperazin-1-…
Find On: PubMed — Wikipedia — Google
CAS Number: 50846-06-5
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) | -0.21 | 2.21 | -87.85 | 4 | 3 | 2 | 35 | 173.304 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.21 | 1.74 | -101.92 | 4 | 3 | 2 | 35 | 173.304 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.21 | -0.26 | -43.93 | 3 | 3 | 1 | 34 | 172.296 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |