| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 11th, 2009 | 16 | No |
Popular Name: 1H-Indene-5,6-diol, 2,3-dihydro-2-[methyl(1-methylethyl)amino]- (9CI) 1H-Indene-5,6-diol, 2,3-dihydro-…
Find On: PubMed — Wikipedia — Google
CAS Number: 793621-56-4
| 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) | 1.81 | 3.5 | -39.33 | 3 | 3 | 1 | 45 | 222.308 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.81 | 1.24 | -8.04 | 2 | 3 | 0 | 44 | 221.3 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.81 | 4.44 | -57.3 | 2 | 3 | 0 | 48 | 221.3 | 2 | ↓ |
