In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 17 | Yes |
Popular Name: N',N'-diethyl-N-[(5-ethyl-2-thienyl)methyl]propane-1,3-diamine N',N'-diethyl-N-[(5-ethyl-2-thie…
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) | 3.24 | 7.88 | -34.21 | 2 | 2 | 1 | 16 | 255.451 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.24 | 9.3 | -104.81 | 3 | 2 | 2 | 21 | 256.459 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.24 | 6.99 | -40.4 | 2 | 2 | 1 | 20 | 255.451 | 9 | ↓ |