| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 15 | Yes |
Popular Name: (3S,4S)-N3-isopentyl-N3,N4-dimethyl-tetrahydropyran-3,4-diamine (3S,4S)-N3-isopentyl-N3,N4-dimet…
None
| 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) | 1.87 | 5.6 | -111.51 | 3 | 3 | 2 | 30 | 216.369 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.87 | 2.79 | -1.01 | 1 | 3 | 0 | 24 | 214.353 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.87 | 3.64 | -34.69 | 2 | 3 | 1 | 29 | 215.361 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.87 | 4.64 | -33.98 | 2 | 3 | 1 | 26 | 215.361 | 5 | ↓ |
