In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 21 | Yes |
Popular Name: (2S)-2-[[(1S)-4-diethylamino-1-methyl-butyl]amino]-1-(1-piperidyl)propan-1-one (2S)-2-[[(1S)-4-diethylamino-1-m…
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) | 2.34 | 8.98 | -98.44 | 3 | 4 | 2 | 41 | 299.503 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.34 | 7.82 | -39.82 | 2 | 4 | 1 | 37 | 298.495 | 9 | ↓ |