In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2006 | 30 | Yes |
Popular Name: N-[3-(4-aminobutyl-(3-aminopropyl)amino)propyl]acridine-9-carboxamide N-[3-(4-aminobutyl-(3-aminopropy…
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) | 1.61 | 6.31 | -200.78 | 8 | 6 | 3 | 102 | 410.586 | 12 | ↓ |
Mid Mid (pH 6-8) | 1.61 | 4.2 | -108.39 | 7 | 6 | 2 | 101 | 409.578 | 12 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | WO1997027179A2 | IBM Patent Data |