In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 16 | Yes |
Popular Name: (1R)-N-ethyl-N-[(1S)-1-methylpropyl]-1-phenyl-ethane-1,2-diamine (1R)-N-ethyl-N-[(1S)-1-methylpro…
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) | 2.31 | 6.49 | -114.84 | 4 | 2 | 2 | 32 | 222.376 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.31 | 4.95 | -42.28 | 3 | 2 | 1 | 31 | 221.368 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.31 | 6.85 | -26.55 | 3 | 2 | 1 | 30 | 221.368 | 6 | ↓ |