In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 19 | Yes |
Popular Name: N,N-diethyl-N'-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]propane-1,3-diamine N,N-diethyl-N'-[(4S)-1-methyl-4,…
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) | 1.03 | 7.85 | -105.86 | 3 | 4 | 2 | 39 | 266.433 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.03 | 6.49 | -35.7 | 2 | 4 | 1 | 34 | 265.425 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.03 | 5.75 | -40.98 | 2 | 4 | 1 | 38 | 265.425 | 7 | ↓ |