In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 13 | Yes |
Popular Name: (2R)-N'-(cyclopropylmethyl)-2-methyl-N'-propyl-propane-1,3-diamine (2R)-N'-(cyclopropylmethyl)-2-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) | 1.64 | 5.95 | -101.75 | 4 | 2 | 2 | 32 | 186.343 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.64 | 4.11 | -41.66 | 3 | 2 | 1 | 31 | 185.335 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.64 | 5.61 | -31.3 | 3 | 2 | 1 | 30 | 185.335 | 7 | ↓ |