In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 14 | Yes |
Popular Name: [3-(4-methylpiperazin-1-yl)propyl](propan-2-yl)amine [3-(4-methylpiperazin-1-yl)propy…
Find On: PubMed — Wikipedia — Google
CAS Number: 1042528-70-0
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) | 0.96 | 4.29 | -84.79 | 3 | 3 | 2 | 24 | 201.358 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.96 | 4.21 | -101.64 | 3 | 3 | 2 | 24 | 201.358 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.96 | 1.81 | -37.69 | 2 | 3 | 1 | 23 | 200.35 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |