| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 13th, 2010 | 15 | Yes |
Popular Name: 3-[[(1S)-1-(3-aminophenyl)ethyl]-methyl-amino]propanenitrile 3-[[(1S)-1-(3-aminophenyl)ethyl]…
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| 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) | 0.81 | 6.07 | -47.76 | 3 | 3 | 1 | 54 | 204.297 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.81 | 3.99 | -7.16 | 2 | 3 | 0 | 53 | 203.289 | 4 | ↓ |
