In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 16 | Yes |
Popular Name: N-[1-(aminomethyl)cyclopentyl]-N',N'-dimethyl-N-propyl-ethane-1,2-diamine N-[1-(aminomethyl)cyclopentyl]-N…
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) | 1.53 | 4.39 | -105.27 | 4 | 3 | 2 | 35 | 229.412 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.53 | 1.9 | -42.15 | 3 | 3 | 1 | 34 | 228.404 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.53 | 5.99 | -218.98 | 5 | 3 | 3 | 37 | 230.42 | 7 | ↓ |