In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 20 | Yes |
Popular Name: (1R)-1-(4-tert-butylphenyl)-N-[(1R)-1-cyclopropylethyl]-N-methyl-ethane-1,2-diamine (1R)-1-(4-tert-butylphenyl)-N-[(…
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) | 3.64 | 9.3 | -121.19 | 4 | 2 | 2 | 32 | 276.468 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.64 | 8.07 | -29.1 | 3 | 2 | 1 | 30 | 275.46 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.64 | 7.11 | -42.78 | 3 | 2 | 1 | 31 | 275.46 | 6 | ↓ |