In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2010 | 17 | Yes |
Popular Name: N'-methyl-N-(3-phenylpropyl)-N-propyl-ethane-1,2-diamine N'-methyl-N-(3-phenylpropyl)-N-p…
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) | 3.33 | 9.33 | -114.58 | 3 | 2 | 2 | 21 | 236.403 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.33 | 5.78 | -2.12 | 1 | 2 | 0 | 15 | 234.387 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.33 | 7.21 | -38.89 | 2 | 2 | 1 | 20 | 235.395 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.33 | 7.9 | -35.26 | 2 | 2 | 1 | 16 | 235.395 | 9 | ↓ |