In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 17 | Yes |
Popular Name: (2S)-N1-isopropyl-N2-methyl-N2-[(2-methyl-3-furyl)methyl]butane-1,2-diamine (2S)-N1-isopropyl-N2-methyl-N2-[…
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) | 2.23 | 5.93 | -32.17 | 2 | 3 | 1 | 33 | 239.383 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.23 | 4.77 | -2.84 | 1 | 3 | 0 | 28 | 238.375 | 7 | ↓ |