| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2011 | 19 | Yes |
Popular Name: N,N-dimethyl-3-[(3R)-3-phenyl-1,4-diazepan-1-yl]propan-1-amine N,N-dimethyl-3-[(3R)-3-phenyl-1,…
| 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 | 7.53 | -84.88 | 3 | 3 | 2 | 24 | 263.429 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.14 | 6.51 | -35.68 | 2 | 3 | 1 | 20 | 262.421 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.14 | 8.47 | -102.25 | 3 | 3 | 2 | 21 | 263.429 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
