In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 16 | Yes |
Popular Name: (1S,2R)-N1-ethyl-N1-isopropyl-1-phenyl-propane-1,2-diamine (1S,2R)-N1-ethyl-N1-isopropyl-1-…
None
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) | 2.18 | 5.69 | -105.21 | 4 | 2 | 2 | 32 | 222.376 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.18 | 4.21 | -38.04 | 3 | 2 | 1 | 31 | 221.368 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.18 | 5.35 | -29.01 | 3 | 2 | 1 | 30 | 221.368 | 5 | ↓ |