In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 20 | Yes |
Popular Name: (2S)-2-[[(1R)-4-diethylamino-1-methyl-butyl]amino]-N-isobutyl-propanamide (2S)-2-[[(1R)-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) | 2.31 | 7.52 | -90.52 | 4 | 4 | 2 | 50 | 287.492 | 11 | ↓ |
Hi High (pH 8-9.5) | 2.31 | 6.55 | -32.01 | 3 | 4 | 1 | 46 | 286.484 | 11 | ↓ |