In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 18 | Yes |
Popular Name: 5-[4-(2-dimethylaminoethyl)-1,4-diazepan-1-yl]pentan-1-amine 5-[4-(2-dimethylaminoethyl)-1,4-…
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) | 0.39 | 5.51 | -149.33 | 5 | 4 | 3 | 40 | 259.462 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.39 | 3.03 | -91.29 | 4 | 4 | 2 | 39 | 258.454 | 8 | ↓ |