In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2008 | 17 | Yes |
Popular Name: (3R)-3-(aminomethyl)-1-benzyl-N,N-dimethyl-pyrrolidin-3-amine (3R)-3-(aminomethyl)-1-benzyl-N,…
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) | 0.77 | 4.26 | -106.26 | 4 | 3 | 2 | 35 | 235.375 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.77 | 3.92 | -34.28 | 3 | 3 | 1 | 34 | 234.367 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.76 | 4.71 | -119.92 | 4 | 3 | 2 | 35 | 235.375 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.76 | 2.67 | -43.33 | 3 | 3 | 1 | 34 | 234.367 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.76 | 4.23 | -31.14 | 3 | 3 | 1 | 34 | 234.367 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.76 | 2.32 | -1.81 | 2 | 3 | 0 | 32 | 233.359 | 4 | ↓ |