In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2011 | 17 | Yes |
Popular Name: 1-[(3R)-3-propyl-3-piperidyl]-N-(2-thienylmethyl)methanamine 1-[(3R)-3-propyl-3-piperidyl]-N-…
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) | 2.74 | 5.99 | -38.9 | 3 | 2 | 1 | 29 | 253.435 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.74 | 7.09 | -115.59 | 4 | 2 | 2 | 33 | 254.443 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.