In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | No |
Popular Name: (2R)-N2-cyclopropyl-4-methylsulfanyl-N2-(3-thienylmethyl)butane-1,2-diamine (2R)-N2-cyclopropyl-4-methylsulf…
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) | 1.28 | 5.73 | -50.18 | 3 | 2 | 1 | 31 | 271.475 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.28 | 7.23 | -129.63 | 4 | 2 | 2 | 32 | 272.483 | 8 | ↓ |