In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 13 | Yes |
Popular Name: N1,N1-diethyl-1-(2-thienyl)ethane-1,2-diamine N1,N1-diethyl-1-(2-thienyl)ethan…
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CAS Number: N/A
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) | 1.38 | 2.88 | -45.29 | 3 | 2 | 1 | 31 | 199.343 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.38 | 2.65 | -2.12 | 2 | 2 | 0 | 29 | 198.335 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.38 | 4.11 | -28.2 | 3 | 2 | 1 | 30 | 199.343 | 5 | ↓ |