| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 25th, 2009 | 23 | Yes |
Popular Name: (1S)-N'-[(4-tert-butylphenyl)methyl]-N,N-dimethyl-1-phenyl-ethane-1,2-diamine (1S)-N'-[(4-tert-butylphenyl)met…
| 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) | 4.81 | 12.04 | -33.99 | 2 | 2 | 1 | 16 | 311.493 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.81 | 10.1 | -2.27 | 1 | 2 | 0 | 15 | 310.485 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.81 | 10.35 | -38.76 | 2 | 2 | 1 | 20 | 311.493 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.81 | 12.73 | -124.18 | 3 | 2 | 2 | 21 | 312.501 | 7 | ↓ |
