In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2010 | 18 | Yes |
Popular Name: N-ethyl-4-[(4-propyl-1-piperidyl)methyl]thiadiazol-5-amine N-ethyl-4-[(4-propyl-1-piperidyl…
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) | 3.32 | 6.55 | -37.74 | 2 | 4 | 1 | 42 | 269.438 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.32 | 4.29 | -6.44 | 1 | 4 | 0 | 41 | 268.43 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.