In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 18 | Yes |
Popular Name: N,N-diethyl-N'-[[5-[(1S,2S)-2-methylcyclopropyl]-2-furyl]methyl]ethane-1,2-diamine N,N-diethyl-N'-[[5-[(1S,2S)-2-me…
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) | 2.73 | 6.75 | -40.15 | 2 | 3 | 1 | 33 | 251.394 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.73 | 5.62 | -2.88 | 1 | 3 | 0 | 28 | 250.386 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.73 | 9.06 | -114.87 | 3 | 3 | 2 | 34 | 252.402 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.73 | 7.64 | -34.99 | 2 | 3 | 1 | 30 | 251.394 | 8 | ↓ |