| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 19 | Yes |
Popular Name: (3S)-3-[4-(1-methyltetrazol-5-yl)-1,4-diazepan-1-yl]pentan-1-amine (3S)-3-[4-(1-methyltetrazol-5-yl…
| 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) | -0.16 | 4.25 | -54.64 | 3 | 7 | 1 | 78 | 268.389 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.16 | 5.5 | -125.74 | 4 | 7 | 2 | 79 | 269.397 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
