| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2010 | 15 | No |
Popular Name: (3S)-3-(aminomethyl)-N-isobutyl-N-isopropyl-tetrahydrothiophen-3-amine (3S)-3-(aminomethyl)-N-isobutyl-…
| 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) | 1.66 | 4.68 | -44.49 | 3 | 2 | 1 | 31 | 231.429 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.66 | 5.72 | -28.69 | 3 | 2 | 1 | 30 | 231.429 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.66 | 5.12 | -118.93 | 4 | 2 | 2 | 32 | 232.437 | 5 | ↓ |
