In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 19 | Yes |
Popular Name: 1-[4-[(4-isopropylpiperazin-1-yl)methyl]-5-methyl-2-furyl]-N-methyl-methanamine 1-[4-[(4-isopropylpiperazin-1-yl…
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) | 1.27 | 5.99 | -79.89 | 3 | 4 | 2 | 37 | 267.417 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.27 | 6.04 | -88.98 | 3 | 4 | 2 | 37 | 267.417 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.