In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 17 | Yes |
Popular Name: (1S)-N-butyl-1-(4-chlorophenyl)-N-ethyl-ethane-1,2-diamine (1S)-N-butyl-1-(4-chlorophenyl)-…
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) | 3.22 | 7.9 | -130.47 | 4 | 2 | 2 | 32 | 256.821 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.22 | 5.92 | -46.87 | 3 | 2 | 1 | 31 | 255.813 | 7 | ↓ |