In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 19 | Yes |
Popular Name: (1R)-N'-(2-dimethylaminoethyl)-N-methyl-1-phenyl-N'-propyl-ethane-1,2-diamine (1R)-N'-(2-dimethylaminoethyl)-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) | 2.62 | 9.72 | -98.96 | 3 | 3 | 2 | 24 | 265.445 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.62 | 7.43 | -33.06 | 2 | 3 | 1 | 20 | 264.437 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.62 | 6.48 | -34.29 | 2 | 3 | 1 | 20 | 264.437 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.62 | 7.24 | -36.04 | 2 | 3 | 1 | 23 | 264.437 | 9 | ↓ |
Lo Low (pH 4.5-6) | 2.62 | 9.37 | -202.27 | 4 | 3 | 3 | 25 | 266.453 | 9 | ↓ |