General Information of This Payload
Payload ID
PAY0UCJXD
Name
TWI857167B-IC-118-PAYLOAD
Synonyms
TWI857167B-IC-118-PAYLOAD
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Structure
Formula
C21H31N5O4S
Isosmiles
CCCN(OCC)C(C(CC(N)=N1)=CC2=C1C=C(S2)CC(C3)CN3C([C@@H](N)CO)=O)=O
InChI
InChI=1S/C21H31N5O4S/c1-3-5-26(30-4-2)20(28)14-7-18-17(24-19(23)8-14)9-15(31-18)6-13-10-25(11-13)21(29)16(22)12-27/h7,9,13,16,27H,3-6,8,10-12,22H2,1-2H3,(H2,23,24)/t16-/m0/s1
InChIKey
WFCKNOPHUASASY-INIZCTEOSA-N
Pharmaceutical Properties
Molecule Weight
449.577
Polar area
134.48
Complexity
827.389395
xlogp Value
1.0345
Heavy Count
31
Rot Bonds
9
Hbond acc
8
Hbond Donor
3
Each Antibody-drug Conjugate Related to This Payload