In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2005 | 22 | Yes |
trans-N-(6,6-DiMethyl-2-hepten-4-ynyl)-N-Methyl-1-naphthylMethylaMine Hydrochloride
trans-N-(6,6-DiMethyl-2-hepten-4-ynyl)-N-Methyl-1-naphthylMethylaMineHydrochloride
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) | 5.72 | 4.55 | -35.84 | 1 | 1 | 1 | 4 | 292.446 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
ALOGPS_SOLUBILITY | 7.38e-04 g/l | DrugBank-approved |