In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 19 | No |
Popular Name: (1S)-N-(2-ethoxyethyl)-1-(3-nitrophenyl)butan-1-amine (1S)-N-(2-ethoxyethyl)-1-(3-nitr…
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) | 2.51 | 8.21 | -48.43 | 2 | 5 | 1 | 72 | 267.349 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.51 | 6.9 | -6.2 | 1 | 5 | 0 | 67 | 266.341 | 9 | ↓ |