In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 16 | Yes |
Popular Name: (2S)-1-[ethyl-[(1S)-2-methoxy-1-methyl-ethyl]amino]-3-(propylamino)propan-2-ol (2S)-1-[ethyl-[(1S)-2-methoxy-1-…
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) | 0.70 | 0.88 | -38.89 | 3 | 4 | 1 | 49 | 233.376 | 10 | ↓ |
Hi High (pH 8-9.5) | 0.70 | -0.46 | -3.62 | 2 | 4 | 0 | 45 | 232.368 | 10 | ↓ |
Mid Mid (pH 6-8) | 0.70 | 3.67 | -34.5 | 3 | 4 | 1 | 53 | 233.376 | 10 | ↓ |