In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2010 | 15 | Yes |
Popular Name: N,N-dimethyl-3-[(2R)-2,5,5-trimethylpiperazin-1-yl]propan-1-amine N,N-dimethyl-3-[(2R)-2,5,5-trime…
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) | 1.43 | 4.83 | -80.47 | 3 | 3 | 2 | 24 | 215.385 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.43 | 5.48 | -93.52 | 3 | 3 | 2 | 21 | 215.385 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.43 | 4.22 | -105.99 | 3 | 3 | 2 | 24 | 215.385 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.43 | 3.01 | -29.36 | 2 | 3 | 1 | 20 | 214.377 | 4 | ↓ |