In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | Yes |
Popular Name: (2S)-N'-[(5-chloro-2-methoxy-phenyl)methyl]-N',2-dimethyl-propane-1,3-diamine (2S)-N'-[(5-chloro-2-methoxy-phe…
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) | 1.95 | 3.94 | -43.37 | 3 | 3 | 1 | 40 | 257.785 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.95 | 5.64 | -33.85 | 3 | 3 | 1 | 40 | 257.785 | 6 | ↓ |