In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2011 | 14 | Yes |
Popular Name: N-methyl-N-[(3S)-1-methyl-3-piperidyl]cyclopropanecarboxamidine N-methyl-N-[(3S)-1-methyl-3-pipe…
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) | 1.31 | 6.69 | -87.15 | 3 | 3 | 2 | 33 | 197.326 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.31 | 4.3 | -25.7 | 2 | 3 | 1 | 32 | 196.318 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.