In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 17 | Yes |
Popular Name: 4-(aminomethyl)-N-[(1S)-1-cyclopropylethyl]-1-ethyl-N-methyl-piperidin-4-amine 4-(aminomethyl)-N-[(1S)-1-cyclop…
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) | 1.21 | 3.73 | -28.36 | 3 | 3 | 1 | 34 | 240.415 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.21 | 3.9 | -34.29 | 3 | 3 | 1 | 34 | 240.415 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.21 | 4.08 | -117.4 | 4 | 3 | 2 | 35 | 241.423 | 5 | ↓ |