In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | Yes |
Popular Name: (2S)-1-[bis(2-methoxyethyl)amino]-3-(propylamino)propan-2-ol (2S)-1-[bis(2-methoxyethyl)amino…
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) | -0.02 | 1.66 | -100.26 | 4 | 5 | 2 | 60 | 250.383 | 12 | ↓ |
Hi High (pH 8-9.5) | -0.02 | -2.02 | -5.99 | 2 | 5 | 0 | 54 | 248.367 | 12 | ↓ |
Mid Mid (pH 6-8) | -0.02 | -0.66 | -40.61 | 3 | 5 | 1 | 59 | 249.375 | 12 | ↓ |
Mid Mid (pH 6-8) | -0.02 | 2.16 | -45.36 | 3 | 5 | 1 | 63 | 249.375 | 12 | ↓ |