| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2011 | 17 | Yes |
Popular Name: (3S,4R)-N3-(cyclobutylmethyl)-N3-methyl-N4-propyl-tetrahydropyran-3,4-diamine (3S,4R)-N3-(cyclobutylmethyl)-N3…
| 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) | 2.14 | 5.45 | -34.23 | 2 | 3 | 1 | 26 | 241.399 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.14 | 3.49 | -1.03 | 1 | 3 | 0 | 24 | 240.391 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.14 | 4.62 | -34.95 | 2 | 3 | 1 | 29 | 241.399 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.14 | 6.63 | -115.4 | 3 | 3 | 2 | 30 | 242.407 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
