In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2010 | 20 | Yes |
Popular Name: N-[[2-[(4-propylpiperazin-1-yl)methyl]-3-furyl]methyl]propan-1-amine N-[[2-[(4-propylpiperazin-1-yl)m…
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) | 2.13 | 6.62 | -96.44 | 3 | 4 | 2 | 37 | 281.444 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.13 | 4.37 | -39.56 | 2 | 4 | 1 | 36 | 280.436 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.