| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 12th, 2013 | 21 | Yes |
Popular Name: N1-(1-BENZYL-4-PIPERIDYL)BENZENE-1,2-DIAMINE N1-(1-BENZYL-4-PIPERIDYL)BENZENE…
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CAS Number: 57718-47-5
| 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) | 4.29 | 8.67 | -3.23 | 3 | 3 | 0 | 41 | 281.403 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.29 | 8.05 | -30.66 | 4 | 3 | 1 | 42 | 282.411 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.29 | 8.52 | -39.71 | 4 | 3 | 1 | 43 | 282.411 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 4.29 | 7.93 | -95.93 | 5 | 3 | 2 | 44 | 283.419 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.