In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2011 | 21 | Yes |
Popular Name: 1-(aminomethyl)-N-(3-methoxypropyl)-N-methyl-4-phenyl-cyclohexanamine 1-(aminomethyl)-N-(3-methoxyprop…
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) | 2.47 | 5.62 | -46.12 | 3 | 3 | 1 | 40 | 291.459 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.47 | 7.03 | -35.78 | 3 | 3 | 1 | 40 | 291.459 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.47 | 7.38 | -130.14 | 4 | 3 | 2 | 41 | 292.467 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.