In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 16 | Yes |
Popular Name: (4R)-N'-(2-dimethylaminoethyl)-N,N-diethyl-pentane-1,4-diamine (4R)-N'-(2-dimethylaminoethyl)-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) | 1.78 | 5.85 | -97.99 | 3 | 3 | 2 | 24 | 231.428 | 10 | ↓ |
Hi High (pH 8-9.5) | 1.78 | 4.83 | -29.92 | 2 | 3 | 1 | 20 | 230.42 | 10 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 8.39 | -188.02 | 4 | 3 | 3 | 25 | 232.436 | 10 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 7.22 | -79.41 | 3 | 3 | 2 | 21 | 231.428 | 10 | ↓ |