In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2010 | 16 | Yes |
Popular Name: N-isopropyl-N'-(3-morpholin-4-ylpropyl)ethane-1,2-diamine N-isopropyl-N'-(3-morpholin-4-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) | 0.35 | 2.12 | -117.26 | 4 | 4 | 2 | 46 | 231.384 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.35 | 0.93 | -41.08 | 3 | 4 | 1 | 41 | 230.376 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.35 | 0.78 | -36.32 | 3 | 4 | 1 | 41 | 230.376 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.35 | 3.04 | -84.2 | 4 | 4 | 2 | 42 | 231.384 | 8 | ↓ |
Lo Low (pH 4.5-6) | 0.35 | 4.38 | -197.57 | 5 | 4 | 3 | 47 | 232.392 | 8 | ↓ |