In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 16 | Yes |
Popular Name: N',N'-dimethyl-N-[(4R)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]ethane-1,2-diamine N',N'-dimethyl-N-[(4R)-1-methyl-…
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) | 0.01 | 4.35 | -37.6 | 2 | 4 | 1 | 34 | 223.344 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.01 | 1.88 | -6.99 | 1 | 4 | 0 | 33 | 222.336 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.01 | 3.27 | -39.74 | 2 | 4 | 1 | 38 | 223.344 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.01 | 5.74 | -114.96 | 3 | 4 | 2 | 39 | 224.352 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.01 | 4.75 | -76.88 | 3 | 4 | 2 | 36 | 224.352 | 4 | ↓ |