In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2009 | 17 | Yes |
Popular Name: N,N-diethyl-N'-(2-phenylsulfanylethyl)ethane-1,2-diamine N,N-diethyl-N'-(2-phenylsulfanyl…
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) | 2.59 | 7.77 | -33.81 | 2 | 2 | 1 | 16 | 253.435 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.59 | 5.67 | -2.87 | 1 | 2 | 0 | 15 | 252.427 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.59 | 6.97 | -43.21 | 2 | 2 | 1 | 20 | 253.435 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.59 | 9.1 | -117.06 | 3 | 2 | 2 | 21 | 254.443 | 9 | ↓ |