In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 16 | Yes |
Popular Name: N-[2-[4-[(1S)-1-methylpropyl]piperazin-1-yl]ethyl]cyclopropanamine N-[2-[4-[(1S)-1-methylpropyl]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) | 1.59 | 5.48 | -84.43 | 3 | 3 | 2 | 24 | 227.396 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.59 | 3.56 | -34.97 | 2 | 3 | 1 | 23 | 226.388 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.