| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 18 | Yes |
Popular Name: 4-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-1-propyl-piperidin-4-amine 4-(aminomethyl)-N-(cyclopropylme…
| 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) | 1.76 | 4.69 | -28.75 | 3 | 3 | 1 | 34 | 254.442 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 5.02 | -118.9 | 4 | 3 | 2 | 35 | 255.45 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 6.75 | -95.32 | 4 | 3 | 2 | 35 | 255.45 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 5.53 | -107.72 | 4 | 3 | 2 | 35 | 255.45 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.76 | 7.25 | -218.62 | 5 | 3 | 3 | 37 | 256.458 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
