In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 19 | Yes |
Popular Name: N-[2-(aminomethyl)-4-chloro-phenyl]-1-ethyl-N-methyl-piperidin-4-amine N-[2-(aminomethyl)-4-chloro-phen…
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) | 2.63 | 7.87 | -101.34 | 4 | 3 | 2 | 35 | 283.847 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.63 | 7.45 | -37.02 | 3 | 3 | 1 | 34 | 282.839 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.