In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2009 | 28 | Yes |
Popular Name: (1S,2S)-N,N'-dibutyl-1,2-bis(3,4-dichlorophenyl)ethane-1,2-diamine (1S,2S)-N,N'-dibutyl-1,2-bis(3,4…
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) | 8.40 | 14.47 | -154.19 | 4 | 2 | 2 | 33 | 464.308 | 11 | ↓ |
Mid Mid (pH 6-8) | 8.40 | 13.18 | -53.49 | 3 | 2 | 1 | 29 | 463.3 | 11 | ↓ |