In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 17 | Yes |
Popular Name: 4-[[(1R)-1-(dimethylaminomethyl)-2-methyl-propyl]amino]-N,N-dimethyl-butanamide 4-[[(1R)-1-(dimethylaminomethyl)…
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) | 0.69 | 6.6 | -117.12 | 3 | 4 | 2 | 41 | 245.411 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.69 | 4.56 | -41.98 | 2 | 4 | 1 | 40 | 244.403 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.69 | 5.5 | -36.77 | 2 | 4 | 1 | 37 | 244.403 | 8 | ↓ |