In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 17 | Yes |
Popular Name: (1S)-N-methyl-N-[(4-methyl-4-piperidyl)methyl]-1-(2-thienyl)ethanamine (1S)-N-methyl-N-[(4-methyl-4-pip…
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) | 2.65 | 7.82 | -92.51 | 3 | 2 | 2 | 21 | 254.443 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.65 | 5.88 | -39.08 | 2 | 2 | 1 | 20 | 253.435 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.