In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2008 | 17 | Yes |
Popular Name: (2R)-N',N',3-trimethyl-N-[(1R)-1-(5-methyl-2-furyl)ethyl]butane-1,2-diamine (2R)-N',N',3-trimethyl-N-[(1R)-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) | 2.67 | 6.49 | -34.21 | 2 | 3 | 1 | 33 | 239.383 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.67 | 8.37 | -109.98 | 3 | 3 | 2 | 34 | 240.391 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.67 | 7.17 | -35.27 | 2 | 3 | 1 | 30 | 239.383 | 6 | ↓ |