In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2011 | 17 | Yes |
Popular Name: N-cyclopropyl-N-methyl-N'-[(4-methylsulfanylphenyl)methyl]ethane-1,2-diamine N-cyclopropyl-N-methyl-N'-[(4-me…
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) | 2.33 | 6.53 | -43.93 | 2 | 2 | 1 | 20 | 251.419 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.33 | 8.96 | -118.38 | 3 | 2 | 2 | 21 | 252.427 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.33 | 7.62 | -34.29 | 2 | 2 | 1 | 16 | 251.419 | 7 | ↓ |